SpectraBase Spectrum ID |
8HRCQTcNQbQ |
Name |
Pentoxyverine-M (OH) I |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
349.225308478 u |
Formula |
C20H31NO4 |
InChI |
InChI=1S/C20H31NO4/c1-3-21(4-2)12-13-24-14-15-25-19(23)20(11-10-18(22)16-20)17-8-6-5-7-9-17/h5-9,18,22H,3-4,10-16H2,1-2H3 |
InChIKey |
UKHJMGLGMFKISH-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
349.471 g/mol |
Nominal Mass |
349 u |
Quality |
992 |
Retention Index |
2419 |
SMILES |
OC1CC(C=2C=CC=CC2)(C(OCCOCCN(CC)CC)=O)CC1 |
SPLASH |
splash10-000i-9300000000-7111ef92288c0058037c |
Sample Comments |
Hydroxyl position uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Carbetapentane-M (OH) I
2-(2-(diethylamino)ethoxy)ethyl 3-hydroxy-1-phenylcyclopentane-1-carboxylate |
Technique |
GC/MS |
Wiley ID |
DD2024_013494 |