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5572_Plate1LC2_07232020.sky.zip

5572 Q500

Document Summary

 

Small Molecule Precursor List

 
Molecule List Note/Annotations
 
Q500_NEG_F1 
Molecule Note/Annotations
Precursor Note/Annotations
LacAcid 89.023989.0239LacAcid1-89.024489.023989.02391
LacAcid-ISTD2 92.034092.0340LacAcid-ISTD21-92.034592.034092.03401
SucAcid 117.0188117.0188SucAcid1-117.0193117.0188117.01881
OH-GlutAcid 147.0294147.0294OH-GlutAcid1-147.0299147.0294147.02941
AconAcid 173.0087173.0087AconAcid1-173.0092173.0087173.00871
p-Cresol-SO4 187.0065187.0065p-Cresol-SO41-187.0070187.0065187.00651
Ind-SO4 212.0018212.0018Ind-SO41-212.0023212.0018212.00181
Q500_NEG_F2 
Molecule Note/Annotations
Precursor Note/Annotations
AbsAcid 263.1284263.1284AbsAcid1-263.1289263.1284263.12841
Met-ISTDN 286.0764286.0764Met-ISTDN1-286.0769286.0764286.07641
DHEAS 367.1580367.1580DHEAS1-367.1585367.1580367.15801
DHEAS-ISTD 373.1956373.1956DHEAS-ISTD1-373.1961373.1956373.19561
TCA 514.2839514.2839TCA1-514.2844514.2839514.28391
TMCA 514.2839514.2839TMCA1-514.2844514.2839514.28391
TCA-ISTD 519.3153519.3153TCA-ISTD1-519.3158519.3153519.31531
Q500_NEG_F3 
Molecule Note/Annotations
Precursor Note/Annotations
DiCA(12:0) 229.1440229.1440DiCA(12:0)1-229.1445229.1440229.14401
GCA 464.3013464.3013GCA1-464.3018464.3013464.30131
GCA-ISTD 469.3326469.3326GCA-ISTD1-469.3331469.3326469.33261
TCDCA 498.2890498.2890TCDCA1-498.2895498.2890498.28901
TDCA 498.2890498.2890TDCA1-498.2895498.2890498.28901
TCDCA-ISTD 503.3204503.3204TCDCA-ISTD1-503.3209503.3204503.32041
Cystine 509.0446509.0446Cystine1-509.0451509.0446509.04461
Q500_NEG_F4 
Molecule Note/Annotations
Precursor Note/Annotations
DiCA(14:0) 257.1753257.1753DiCA(14:0)1-257.1758257.1753257.17531
CA 407.2798407.2798CA1-407.2803407.2798407.27981
CA-ISTD 412.3112412.3112CA-ISTD1-412.3117412.3112412.31121
CA-ISTD2 412.3112412.3112CA-ISTD21-412.3117412.3112412.31121
GUDCA 448.3064448.3064GUDCA1-448.3069448.3064448.30641
GCDCA 448.3064448.3064GCDCA1-448.3069448.3064448.30641
GDCA 448.3064448.3064GDCA1-448.3069448.3064448.30641
GLCAS 512.2682512.2682GLCAS1-512.2687512.2682512.26821
Q500_NEG_F5 
Molecule Note/Annotations
Precursor Note/Annotations
DCA 391.2849391.2849DCA1-391.2854391.2849391.28491
CDCA 391.2849391.2849CDCA1-391.2854391.2849391.28491
CDCA-ISTD 396.3163396.3163CDCA-ISTD1-396.3168396.3163396.31631
GLCA 432.3114432.3114GLCA1-432.3119432.3114432.31141
GLCA-ISTD 436.3365436.3365GLCA-ISTD1-436.3370436.3365436.33651
TLCA 482.2941482.2941TLCA1-482.2946482.2941482.29411
Q500_NEG_F6 
Molecule Note/Annotations
Precursor Note/Annotations
FA(12:0) 299.0955299.0955FA(12:0)1-299.0960299.0955299.09551
FA(12:0)-ISTD 302.1144302.1144FA(12:0)-ISTD1-302.1149302.1144302.11441
Q500_NEG_F7 
Molecule Note/Annotations
Precursor Note/Annotations
EPA 301.2168301.2168EPA1-301.2173301.2168301.21681
AA 303.2325303.2325AA1-303.2330303.2325303.23251
FA(14:0) 327.1268327.1268FA(14:0)1-327.1273327.1268327.12681
DHA 327.2325327.2325DHA1-327.2330327.2325327.23251
FA(18:2) 379.1582379.1582FA(18:2)1-379.1587379.1582379.15821
FA(20:3) 405.1738405.1738FA(20:3)1-405.1743405.1738405.17381
Q500_NEG_F8 
Molecule Note/Annotations
Precursor Note/Annotations
FA(16:0) 355.1582355.1582FA(16:0)1-355.1587355.1582355.15821
FA(16:0)-ISTD 358.1770358.1770FA(16:0)-ISTD1-358.1775358.1770358.17701
FA(18:1) 381.1738381.1738FA(18:1)1-381.1743381.1738381.17381
FA(20:2) 407.1895407.1895FA(20:2)1-407.1900407.1895407.18951
Q500_NEG_F9 
Molecule Note/Annotations
Precursor Note/Annotations
FA(18:0) 383.1895383.1895FA(18:0)1-383.1900383.1895383.18951
FA(18:0)-ISTD 386.2083386.2083FA(18:0)-ISTD1-386.2088386.2083386.20831
FA(20:1) 409.2051409.2051FA(20:1)1-409.2056409.2051409.20511