| SpectraBase Spectrum ID |
EqIF5FaKU9p |
| Name |
Trihexyphenidyl-M -H2O 3AC |
| Classification |
Antiparkinsonian |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
457.246437845 u |
| Formula |
C26H35NO6 |
| InChI |
InChI=1S/C26H35NO6/c1-18(28)31-23-11-14-27(15-12-23)16-13-24(21-7-5-4-6-8-21)22-9-10-25(32-19(2)29)26(17-22)33-20(3)30/h4-8,13,22-23,25-26H,9-12,14-17H2,1-3H3/b24-13- |
| InChIKey |
MBOUSXULMWYQRZ-CFRMEGHHSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
457.567 g/mol |
| SMILES |
c1cccc(c1)\C(C1CC(OC(=O)C)C(CC1)OC(=O)C)=C\CN1CCC(CC1)OC(=O)C |
| SPLASH |
splash10-0a4i-5910000000-c9f42151cbde58e30439 |
| 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 (tri-HO-) -H2O 3AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1305 |
