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  1. Targeted MS Runs

GAG_Hawkridge_2025-03-05_12-49-07.sky.zip

Hawkridge

Document Summary

 

Small Molecule Transition List

 
 
GAG 
D2A6(I-A)C14H21O17N1S2539.4451539.0251D2A6(I-A)539.4451540.03241+D2A6(I-A)540.0324 
D2A6(I-A)C14H21O17N1S2539.4451539.0251D2A6(I-A)539.4451540.03241+D2A6(I-A)541.0353 
D2A6(I-A)C14H21O17N1S2539.4451539.0251D2A6(I-A)539.4451562.01431+D2A6(I-A)562.0143 
D2A6(I-A)C14H21O17N1S2539.4451539.0251D2A6(I-A)539.4451562.01431+D2A6(I-A)563.0173 
D2A6(I-A)C14H21O17N1S2539.4451539.0251D2A6(I-A)539.4451583.99631+D2A6(I-A)583.9963 
D2A6(I-A)C14H21O17N1S2539.4451539.0251D2A6(I-A)539.4451583.99631+D2A6(I-A)584.9992 
D0A6(II-A)C14H21O14N1S1459.3819459.0683D0A6(II-A)459.3819460.07561+D0A6(II-A)460.0756 
D0A6(II-A)C14H21O14N1S1459.3819459.0683D0A6(II-A)459.3819460.07561+D0A6(II-A)461.0787 
D0A6(II-A)C14H21O14N1S1459.3819459.0683D0A6(II-A)459.3819482.05751+D0A6(II-A)482.0575 
D0A6(II-A)C14H21O14N1S1459.3819459.0683D0A6(II-A)459.3819482.05751+D0A6(II-A)483.0606 
D0A6(II-A)C14H21O14N1S1459.3819459.0683D0A6(II-A)459.3819504.03941+D0A6(II-A)504.0394 
D0A6(II-A)C14H21O14N1S1459.3819459.0683D0A6(II-A)459.3819504.03941+D0A6(II-A)505.0426 
D2A0(III-A)C14H21O14N1S1459.3819459.0683D2A0(III-A)459.3819460.07561+D2A0(III-A)460.0756 
D2A0(III-A)C14H21O14N1S1459.3819459.0683D2A0(III-A)459.3819460.07561+D2A0(III-A)461.0787 
D2A0(III-A)C14H21O14N1S1459.3819459.0683D2A0(III-A)459.3819482.05751+D2A0(III-A)482.0575 
D2A0(III-A)C14H21O14N1S1459.3819459.0683D2A0(III-A)459.3819482.05751+D2A0(III-A)483.0606 
D2A0(III-A)C14H21O14N1S1459.3819459.0683D2A0(III-A)459.3819504.03941+D2A0(III-A)504.0394 
D2A0(III-A)C14H21O14N1S1459.3819459.0683D2A0(III-A)459.3819504.03941+D2A0(III-A)505.0426 
D0A0(IV-A)C14H21O11N1379.3187379.1115D0A0(IV-A)379.3187380.11871+D0A0(IV-A)380.1187 
D0A0(IV-A)C14H21O11N1379.3187379.1115D0A0(IV-A)379.3187380.11871+D0A0(IV-A)381.1220 
D0A0(IV-A)C14H21O11N1379.3187379.1115D0A0(IV-A)379.3187402.10071+D0A0(IV-A)402.1007 
D0A0(IV-A)C14H21O11N1379.3187379.1115D0A0(IV-A)379.3187402.10071+D0A0(IV-A)403.1040 
D0A0(IV-A)C14H21O11N1379.3187379.1115D0A0(IV-A)379.3187424.08261+D0A0(IV-A)424.0826 
D0A0(IV-A)C14H21O11N1379.3187379.1115D0A0(IV-A)379.3187424.08261+D0A0(IV-A)425.0859 
D2S6(I-S)C12H19O19N1S3577.4714576.9713D2S6(I-S)577.4714577.97861+D2S6(I-S)577.9786 
D2S6(I-S)C12H19O19N1S3577.4714576.9713D2S6(I-S)577.4714577.97861+D2S6(I-S)578.9814 
D2S6(I-S)C12H19O19N1S3577.4714576.9713D2S6(I-S)577.4714599.96061+D2S6(I-S)599.9606 
D2S6(I-S)C12H19O19N1S3577.4714576.9713D2S6(I-S)577.4714599.96061+D2S6(I-S)600.9633 
D2S6(I-S)C12H19O19N1S3577.4714576.9713D2S6(I-S)577.4714621.94251+D2S6(I-S)621.9425 
D2S6(I-S)C12H19O19N1S3577.4714576.9713D2S6(I-S)577.4714621.94251+D2S6(I-S)622.9452 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082418.06501+D0S6(II-S)418.0650 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082418.06501+D0S6(II-S)419.0681 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082440.04691+D0S6(II-S)440.0469 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082440.04691+D0S6(II-S)441.0500 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082462.02891+D0S6(II-S)462.0289 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082462.02891+D0S6(II-S)463.0319 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082498.02181+D0S6(II-S)498.0218 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082498.02181+D0S6(II-S)499.0247 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082520.00371+D0S6(II-S)520.0037 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082520.00371+D0S6(II-S)521.0066 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082541.98571+D0S6(II-S)541.9857 
D0S6(II-S)C12H19O16N1S2497.4082497.0145D0S6(II-S)497.4082541.98571+D0S6(II-S)542.9886 
D2S0(III-S)C12H19O16N1S2497.4082497.0145D2S0(III-S)497.4082498.02181+D2S0(III-S)498.0218 
D2S0(III-S)C12H19O16N1S2497.4082497.0145D2S0(III-S)497.4082498.02181+D2S0(III-S)499.0247 
D2S0(III-S)C12H19O16N1S2497.4082497.0145D2S0(III-S)497.4082520.00371+D2S0(III-S)520.0037 
D2S0(III-S)C12H19O16N1S2497.4082497.0145D2S0(III-S)497.4082520.00371+D2S0(III-S)521.0066 
D2S0(III-S)C12H19O16N1S2497.4082497.0145D2S0(III-S)497.4082541.98571+D2S0(III-S)541.9857 
D2S0(III-S)C12H19O16N1S2497.4082497.0145D2S0(III-S)497.4082541.98571+D2S0(III-S)542.9886 
D0S0(IV-S)C12H19O13N1S1417.3450417.0577D0S0(IV-S)417.3450418.06501+D0S0(IV-S)418.0650 
D0S0(IV-S)C12H19O13N1S1417.3450417.0577D0S0(IV-S)417.3450418.06501+D0S0(IV-S)419.0681 
D0S0(IV-S)C12H19O13N1S1417.3450417.0577D0S0(IV-S)417.3450440.04691+D0S0(IV-S)440.0469 
D0S0(IV-S)C12H19O13N1S1417.3450417.0577D0S0(IV-S)417.3450440.04691+D0S0(IV-S)441.0500 
D0S0(IV-S)C12H19O13N1S1417.3450417.0577D0S0(IV-S)417.3450462.02891+D0S0(IV-S)462.0289 
D0S0(IV-S)C12H19O13N1S1417.3450417.0577D0S0(IV-S)417.3450462.02891+D0S0(IV-S)463.0319 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082498.02181+D2H6(I-H)498.0218 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082498.02181+D2H6(I-H)499.0247 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082520.00371+D2H6(I-H)520.0037 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082520.00371+D2H6(I-H)521.0066 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082541.98571+D2H6(I-H)541.9857 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082541.98571+D2H6(I-H)542.9886 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082271.49652+D2H6(I-H)271.4965 
D2H6(I-H)C12H19O16N1S2497.4082497.0145D2H6(I-H)497.4082271.49652+D2H6(I-H)271.9979 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450418.06501+D0H6(II-H)418.0650 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450418.06501+D0H6(II-H)419.0681 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450440.04691+D0H6(II-H)440.0469 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450440.04691+D0H6(II-H)441.0500 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450462.02891+D0H6(II-H)462.0289 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450462.02891+D0H6(II-H)463.0319 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450231.51812+D0H6(II-H)231.5181 
D0H6(II-H)C12H19O13N1S1417.3450417.0577D0H6(II-H)417.3450231.51812+D0H6(II-H)232.0196 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450418.06501+D2H0(III-H)418.0650 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450418.06501+D2H0(III-H)419.0681 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450440.04691+D2H0(III-H)440.0469 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450440.04691+D2H0(III-H)441.0500 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450462.02891+D2H0(III-H)462.0289 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450462.02891+D2H0(III-H)463.0319 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450231.51812+D2H0(III-H)231.5181 
D2H0(III-H)C12H19O13N1S1417.3450417.0577D2H0(III-H)417.3450231.51812+D2H0(III-H)232.0196 
D0H0(IV-H)C12H19O10N1337.2818337.1009D0H0(IV-H)337.2818338.10821+D0H0(IV-H)338.1082 
D0H0(IV-H)C12H19O10N1337.2818337.1009D0H0(IV-H)337.2818338.10821+D0H0(IV-H)339.1114 
D0H0(IV-H)C12H19O10N1337.2818337.1009D0H0(IV-H)337.2818360.09011+D0H0(IV-H)360.0901 
D0H0(IV-H)C12H19O10N1337.2818337.1009D0H0(IV-H)337.2818360.09011+D0H0(IV-H)361.0934 
D0H0(IV-H)C12H19O10N1337.2818337.1009D0H0(IV-H)337.2818382.07211+D0H0(IV-H)382.0721 
D0H0(IV-H)C12H19O10N1337.2818337.1009D0H0(IV-H)337.2818382.07211+D0H0(IV-H)383.0753 
GAG-IS 
D2A6_13C6(I-A)C14H21O17NS2539.4451539.0251D2A6_13C6(I-A)539.4451546.05251+D2A6_13C6(I-A)546.0525 
D2A6_13C6(I-A)C14H21O17NS2539.4451539.0251D2A6_13C6(I-A)539.4451546.05251+D2A6_13C6(I-A)547.0550 
D2A6_13C6(I-A)C14H21O17NS2539.4451539.0251D2A6_13C6(I-A)539.4451568.03441+D2A6_13C6(I-A)568.0344 
D2A6_13C6(I-A)C14H21O17NS2539.4451539.0251D2A6_13C6(I-A)539.4451568.03441+D2A6_13C6(I-A)569.0369 
D2A6_13C6(I-A)C14H21O17NS2539.4451539.0251D2A6_13C6(I-A)539.4451590.01641+D2A6_13C6(I-A)590.0164 
D2A6_13C6(I-A)C14H21O17NS2539.4451539.0251D2A6_13C6(I-A)539.4451590.01641+D2A6_13C6(I-A)591.0189 
D0A6_13C6(II-A)C14H21O14NS459.3819459.0683D0A6_13C6(II-A)459.3819466.09571+D0A6_13C6(II-A)466.0957 
D0A6_13C6(II-A)C14H21O14NS459.3819459.0683D0A6_13C6(II-A)459.3819466.09571+D0A6_13C6(II-A)467.0985 
D0A6_13C6(II-A)C14H21O14NS459.3819459.0683D0A6_13C6(II-A)459.3819488.07761+D0A6_13C6(II-A)488.0776 
D0A6_13C6(II-A)C14H21O14NS459.3819459.0683D0A6_13C6(II-A)459.3819488.07761+D0A6_13C6(II-A)489.0805 
D0A6_13C6(II-A)C14H21O14NS459.3819459.0683D0A6_13C6(II-A)459.3819510.05961+D0A6_13C6(II-A)510.0596 
D0A6_13C6(II-A)C14H21O14NS459.3819459.0683D0A6_13C6(II-A)459.3819510.05961+D0A6_13C6(II-A)511.0624 
D2A0_13C6(III-A)C14H21O14NS459.3819459.0683D2A0_13C6(III-A)459.3819466.09571+D2A0_13C6(III-A)466.0957 
D2A0_13C6(III-A)C14H21O14NS459.3819459.0683D2A0_13C6(III-A)459.3819466.09571+D2A0_13C6(III-A)467.0985 
D2A0_13C6(III-A)C14H21O14NS459.3819459.0683D2A0_13C6(III-A)459.3819488.07761+D2A0_13C6(III-A)488.0776 
D2A0_13C6(III-A)C14H21O14NS459.3819459.0683D2A0_13C6(III-A)459.3819488.07761+D2A0_13C6(III-A)489.0805 
D2A0_13C6(III-A)C14H21O14NS459.3819459.0683D2A0_13C6(III-A)459.3819510.05961+D2A0_13C6(III-A)510.0596 
D2A0_13C6(III-A)C14H21O14NS459.3819459.0683D2A0_13C6(III-A)459.3819510.05961+D2A0_13C6(III-A)511.0624 
D0A0_13C6(IV-A)C14H21O11N379.3187379.1115D0A0_13C6(IV-A)379.3187386.13891+D0A0_13C6(IV-A)386.1389 
D0A0_13C6(IV-A)C14H21O11N379.3187379.1115D0A0_13C6(IV-A)379.3187386.13891+D0A0_13C6(IV-A)387.1421 
D0A0_13C6(IV-A)C14H21O11N379.3187379.1115D0A0_13C6(IV-A)379.3187408.12081+D0A0_13C6(IV-A)408.1208 
D0A0_13C6(IV-A)C14H21O11N379.3187379.1115D0A0_13C6(IV-A)379.3187408.12081+D0A0_13C6(IV-A)409.1240 
D0A0_13C6(IV-A)C14H21O11N379.3187379.1115D0A0_13C6(IV-A)379.3187430.10281+D0A0_13C6(IV-A)430.1028 
D0A0_13C6(IV-A)C14H21O11N379.3187379.1115D0A0_13C6(IV-A)379.3187430.10281+D0A0_13C6(IV-A)431.1060 
D2S6_13C6(I-S)C12H19O19NS3577.4714576.9713D2S6_13C6(I-S)577.4714583.99871+D2S6_13C6(I-S)583.9987 
D2S6_13C6(I-S)C12H19O19NS3577.4714576.9713D2S6_13C6(I-S)577.4714583.99871+D2S6_13C6(I-S)585.0007 
D2S6_13C6(I-S)C12H19O19NS3577.4714576.9713D2S6_13C6(I-S)577.4714605.98071+D2S6_13C6(I-S)605.9807 
D2S6_13C6(I-S)C12H19O19NS3577.4714576.9713D2S6_13C6(I-S)577.4714605.98071+D2S6_13C6(I-S)606.9827 
D2S6_13C6(I-S)C12H19O19NS3577.4714576.9713D2S6_13C6(I-S)577.4714627.96261+D2S6_13C6(I-S)627.9626 
D2S6_13C6(I-S)C12H19O19NS3577.4714576.9713D2S6_13C6(I-S)577.4714627.96261+D2S6_13C6(I-S)628.9646 
D0S6_13C6(II-S)C12H19O16NS2497.4082497.0145D0S6_13C6(II-S)497.4082504.04191+D0S6_13C6(II-S)504.0419 
D0S6_13C6(II-S)C12H19O16NS2497.4082497.0145D0S6_13C6(II-S)497.4082504.04191+D0S6_13C6(II-S)505.0442 
D0S6_13C6(II-S)C12H19O16NS2497.4082497.0145D0S6_13C6(II-S)497.4082526.02391+D0S6_13C6(II-S)526.0239 
D0S6_13C6(II-S)C12H19O16NS2497.4082497.0145D0S6_13C6(II-S)497.4082526.02391+D0S6_13C6(II-S)527.0262 
D0S6_13C6(II-S)C12H19O16NS2497.4082497.0145D0S6_13C6(II-S)497.4082548.00581+D0S6_13C6(II-S)548.0058 
D0S6_13C6(II-S)C12H19O16NS2497.4082497.0145D0S6_13C6(II-S)497.4082548.00581+D0S6_13C6(II-S)549.0081 
D2S0_13C6(III-S)C12H19O16NS2497.4082497.0145D2S0_13C6(III-S)497.4082504.04191+D2S0_13C6(III-S)504.0419 
D2S0_13C6(III-S)C12H19O16NS2497.4082497.0145D2S0_13C6(III-S)497.4082504.04191+D2S0_13C6(III-S)505.0442 
D2S0_13C6(III-S)C12H19O16NS2497.4082497.0145D2S0_13C6(III-S)497.4082526.02391+D2S0_13C6(III-S)526.0239 
D2S0_13C6(III-S)C12H19O16NS2497.4082497.0145D2S0_13C6(III-S)497.4082526.02391+D2S0_13C6(III-S)527.0262 
D2S0_13C6(III-S)C12H19O16NS2497.4082497.0145D2S0_13C6(III-S)497.4082548.00581+D2S0_13C6(III-S)548.0058 
D2S0_13C6(III-S)C12H19O16NS2497.4082497.0145D2S0_13C6(III-S)497.4082548.00581+D2S0_13C6(III-S)549.0081 
D0S0_13C6(IV-S)C12H19O13NS417.3450417.0577D0S0_13C6(IV-S)417.3450424.08511+D0S0_13C6(IV-S)424.0851 
D0S0_13C6(IV-S)C12H19O13NS417.3450417.0577D0S0_13C6(IV-S)417.3450424.08511+D0S0_13C6(IV-S)425.0878 
D0S0_13C6(IV-S)C12H19O13NS417.3450417.0577D0S0_13C6(IV-S)417.3450446.06711+D0S0_13C6(IV-S)446.0671 
D0S0_13C6(IV-S)C12H19O13NS417.3450417.0577D0S0_13C6(IV-S)417.3450446.06711+D0S0_13C6(IV-S)447.0697 
D0S0_13C6(IV-S)C12H19O13NS417.3450417.0577D0S0_13C6(IV-S)417.3450468.04901+D0S0_13C6(IV-S)468.0490 
D0S0_13C6(IV-S)C12H19O13NS417.3450417.0577D0S0_13C6(IV-S)417.3450468.04901+D0S0_13C6(IV-S)469.0517