| SpectraBase Spectrum ID |
1NijHrEUpk |
| Name |
Benazepril-M/artifact iso-2 3ME @ |
| Classification |
Antihypertensive |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
454.210386688 u |
| Formula |
C25H30N2O6 |
| InChI |
InChI=1S/C25H30N2O6/c1-31-19-9-6-7-17(15-19)11-13-21(25(30)33-3)26-20-14-12-18-8-4-5-10-22(18)27(24(20)29)16-23(28)32-2/h4-10,15,20-21,26H,11-14,16H2,1-3H3 |
| InChIKey |
JFIAAIJNHGFJJD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
454.523 g/mol |
| SMILES |
c1cc2c(N(C(C(NC(C(=O)OC)CCc3cc(OC)ccc3)CC2)=O)CC(=O)OC)cc1 |
| SPLASH |
splash10-0fl1-2953100000-f6fbbdfb49882ae9701e |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: UME |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Benazeprilate-M (HO-) isomer-2 3ME
Benazepril-M/artifact (deethyl-HO-) isomer-2 3ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_4719 |
