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 |