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Phenformin-A (-H2O) 2AC II
SpectraBase Compound ID 6RlDZOBZDJy
InChI InChI=1S/C14H17N5O/c1-10-17-14(18-13(15)19(10)11(2)20)16-9-8-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H2,15,16,18)
InChIKey AASAXPBOPVCIST-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C14H17N5O
Exact Mass 271.14331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WJHt1e0a3M
Name Phenformin-A (-H2O) 2AC II
Classification Pharmaceutical drug metabolite, artifact derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 271.143310186 u
Formula C14H17N5O
InChI InChI=1S/C14H17N5O/c1-10-17-14(18-13(15)19(10)11(2)20)16-9-8-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H2,15,16,18)
InChIKey AASAXPBOPVCIST-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 271.324 g/mol
Nominal Mass 271 u
Quality 986
Retention Index 2329
SMILES NC=1N(C(=N\C(N1)=N/CCC1=CC=CC=C1)C)C(=O)C
SPLASH splash10-0083-6930000000-b2e1da96a98e7f7000d5
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2-amino-6-methyl-4-((2-phenylethyl)imino)-1,3,5-triazin-1(4H)-yl)ethan-1-one
Technique GC/MS
Wiley ID DD2024_008056