LCMSTestmix All Participants_2018-11-26_14-21-04.sky.zip

Duke - p400HR Ring Trial System Suitability
ListDescriptionProtein Annotations 
Amino Acids 
MoleculeIon FormulaMolecule AnnotationsMass AverageMass MonoisotopicPrecursorPrecursor AnnotationsMass AverageQ1 m/zQ1 ZFragmentQ3 m/zQ3 Z
Ala 225.0698225.0698Ala225.0698225.06921+Ala225.0692 
Arg 310.1338310.1338Arg310.1338310.13321+Arg310.1332 
Asn 268.0756268.0756Asn268.0756268.07501+Asn268.0750 
Asp 269.0596269.0596Asp269.0596269.05911+Asp269.0591 
Cit 311.1178311.1178Cit311.1178311.11721+Cit311.1172 
Gln 282.0912282.0912Gln282.0912282.09071+Gln282.0907 
Glu 283.0752283.0752Glu283.0752283.07471+Glu283.0747 
Gly 211.0541211.0541Gly211.0541211.05361+Gly211.0536 
His 291.0916291.0916His291.0916291.09101+His291.0910 
xLeu 267.1167267.1167xLeu267.1167267.11621+xLeu267.1162 
Lys 417.1419417.1419Lys417.1419417.14131+Lys417.1413 
Met 285.0731285.0731Met285.0731285.07261+Met285.0726 
Orn 403.1262403.1262Orn403.1262403.12571+Orn403.1257 
Phe 301.1011301.1011Phe301.1011301.10051+Phe301.1005 
Pro 251.0854251.0854Pro251.0854251.08491+Pro251.0849 
Ser 241.0647241.0647Ser241.0647241.06411+Ser241.0641 
Thr 255.0803255.0803Thr255.0803255.07981+Thr255.0798 
Trp 340.1120340.1120Trp340.1120340.11141+Trp340.1114 
Tyr 317.0960317.0960Tyr317.0960317.09541+Tyr317.0954 
Val 253.1011253.1011Val253.1011253.10051+Val253.1005 
Biogenic Amines 
MoleculeIon FormulaMolecule AnnotationsMass AverageMass MonoisotopicPrecursorPrecursor AnnotationsMass AverageQ1 m/zQ1 ZFragmentQ3 m/zQ3 Z
AcOrn 310.1225310.1225AcOrn310.1225310.12201+AcOrn310.1220 
ADMA 338.1651338.1651ADMA338.1651338.16451+ADMA338.1645 
SDMA 338.1651338.1651SDMA338.1651338.16451+SDMA338.1645 
alpha-AAA 297.0909297.0909alpha-AAA297.0909297.09041+alpha-AAA297.0904 
Carnosine 362.1287362.1287Carnosine362.1287362.12811+Carnosine362.1281 
Creatinine 114.0667114.0667Creatinine114.0667114.06621+Creatinine114.0662 
DOPA 333.0909333.0909DOPA333.0909333.09041+DOPA333.0904 
Dopamine 289.1011289.1011Dopamine289.1011289.10051+Dopamine289.1005 
Histamine 247.1017247.1017Histamine247.1017247.10121+Histamine247.1012 
Kynurenine 344.1069344.1069Kynurenine344.1069344.10631+Kynurenine344.1063 
Met-SO 301.0681301.0681Met-SO301.0681301.06751+Met-SO301.0675 
Nitro-Tyr 362.0811362.0811Nitro-Tyr362.0811362.08051+Nitro-Tyr362.0805 
c4-OH-Pro 267.0803267.0803c4-OH-Pro267.0803267.07981+c4-OH-Pro267.0798 
t4-OH-Pro 267.0803267.0803t4-OH-Pro267.0803267.07981+t4-OH-Pro267.0798 
PEA 257.1112257.1112PEA257.1112257.11071+PEA257.1107 
Putrescine 359.1358359.1358Putrescine359.1358359.13531+Putrescine359.1353 
Sarcosine 225.0698225.0698Sarcosine225.0698225.06921+Sarcosine225.0692 
Serotonin 312.1171312.1171Serotonin312.1171312.11651+Serotonin312.1165 
Spermidine 551.2085551.2085Spermidine551.2085551.20801+Spermidine551.2080 
Spermine 743.2806743.2806Spermine743.2806743.28011+Spermine743.2801 
Taurine 261.0368261.0368Taurine261.0368261.03621+Taurine261.0362