| SpectraBase Spectrum ID |
4gw8jZ1CUzy |
| Name |
Perhexiline-M (di-HO-) -H2O 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 |
375.277344052 u |
| Formula |
C23H37NO3 |
| InChI |
InChI=1S/C23H37NO3/c1-17(25)24-15-7-6-10-21(24)16-23(19-8-4-3-5-9-19)20-11-13-22(14-12-20)27-18(2)26/h3-4,19-23H,5-16H2,1-2H3 |
| InChIKey |
QLXUIYPXQNHFJG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
375.553 g/mol |
| SMILES |
C1CC(OC(C)=O)CCC1C(CC1CCCCN1C(C)=O)C1CCC=CC1 |
| SPLASH |
splash10-0059-8911000000-3bfe5c762b39aea90731 |
| 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: 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_3400 |
