SpectraBase Spectrum ID |
8JYARDqZrai |
Name |
Ramipril-M (Desethyl) 2ME |
Classification |
Pharmaceutical drug metabolite |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
416.231122133 u |
Formula |
C23H32N2O5 |
InChI |
InChI=1S/C23H32N2O5/c1-15(24-18(22(27)29-2)13-12-16-8-5-4-6-9-16)21(26)25-19-11-7-10-17(19)14-20(25)23(28)30-3/h4-6,8-9,15,17-20,24H,7,10-14H2,1-3H3/t15-,17+,18-,19+,20+/m1/s1 |
InChIKey |
YEJXTMAYOXHDIE-XZEJUNMKSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
416.518 g/mol |
Nominal Mass |
416 u |
Quality |
934 |
SMILES |
[C@]12([C@](C[C@](N2C([C@](N[C@@](C(OC)=O)(CCC=2C=CC=CC2)[H])(C)[H])=O)(C(OC)=O)[H])(CCC1)[H])[H] |
SPLASH |
splash10-00di-6590000000-c48c0b2ddf8ae5576376 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
methyl (2S,3aS,6aS)-1-((2R)-2-(((2R)-1-methoxy-1-oxo-4-phenylbutan-2-yl)amino)\rpropanoyl)octahydrocyclopenta[b]pyrrole-2-carboxylate |
Technique |
DI/MS |
Wiley ID |
DD2024_003844 |