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Glipizid-M (480) isomer 2 MS3_1
SpectraBase Compound ID 4XE6dCuLpkE
InChI InChI=1S/C14H16N4O4S/c15-23(21,22)12-3-1-10(2-4-12)5-6-16-14(20)13-8-17-11(9-19)7-18-13/h1-4,7-8,19H,5-6,9H2,(H,16,20)(H2,15,21,22)/p+1
InChIKey PKBZPCWWHDSJIO-UHFFFAOYSA-O
Mol Weight 337.37 g/mol
Molecular Formula C14H17N4O4S
Exact Mass 337.097051 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID FVLEPYm3b8R
Name Glipizid-M (480) isomer 2 MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [80.00-350.00]
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InChI InChI=1S/C14H16N4O4S/c15-23(21,22)12-3-1-10(2-4-12)5-6-16-14(20)13-8-17-11(9-19)7-18-13/h1-4,7-8,19H,5-6,9H2,(H,16,20)(H2,15,21,22)/p+1
InChIKey PKBZPCWWHDSJIO-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [NH3+]S(C1=CC=C(CCNC(C2=NC=C(CO)N=C2)=O)C=C1)(=O)=O
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS