| SpectraBase Spectrum ID |
23m23aIIvsu |
| Name |
Trihexyphenidyl-M -H2O isom-2 2AC |
| Classification |
Antiparkinsonian |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
399.240958543 u |
| Formula |
C24H33NO4 |
| InChI |
InChI=1S/C24H33NO4/c1-18(26)28-23-12-11-21(17-24(23)29-19(2)27)22(20-9-5-3-6-10-20)13-16-25-14-7-4-8-15-25/h3,5-6,9-10,13,21,23-24H,4,7-8,11-12,14-17H2,1-2H3/b22-13- |
| InChIKey |
MJIMJVSYXBKLMS-XKZIYDEJSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
399.531 g/mol |
| SMILES |
C(N1CCCCC1)\C=C/(C1CC(OC(=O)C)C(OC(=O)C)CC1)c1ccccc1 |
| SPLASH |
splash10-0002-8920000000-1744f7d84b37cbe4d7dc |
| 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 |
| Synonyms |
Trihexyphenidyl-M (di-HO-) -H2O isomer-2 2AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1304 |
