| SpectraBase Spectrum ID |
20tTQSMlyi |
| Name |
Verapamil-M (nor-O-demethyl-) 2AC |
| Classification |
Ca Antagonist |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
510.272986946 u |
| Formula |
C29H38N2O6 |
| InChI |
InChI=1S/C29H38N2O6/c1-20(2)29(19-30,24-10-12-26(37-22(4)33)28(18-24)36-7)14-8-15-31(21(3)32)16-13-23-9-11-25(34-5)27(17-23)35-6/h9-12,17-18,20H,8,13-16H2,1-7H3 |
| InChIKey |
UFNYSMZHVXJWOU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
510.631 g/mol |
| SMILES |
CC(N(CCc1cc(OC)c(OC)cc1)CCCC(c1cc(c(cc1)OC(C)=O)OC)(C#N)C(C)C)=O |
| SPLASH |
splash10-03di-0901000000-b87d84785a3bd49c3ec0 |
| 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: U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6399 |
