SpectraBase Spectrum ID |
8Go0M907kwK |
Name |
Pentoxyverine-M (OH) II |
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)13-14-24-15-16-25-19(23)20(12-8-11-18(20)22)17-9-6-5-7-10-17/h5-7,9-10,18,22H,3-4,8,11-16H2,1-2H3 |
InChIKey |
FTGBPUOVVRNKDN-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
349.471 g/mol |
Nominal Mass |
349 u |
Quality |
974 |
Retention Index |
2466 |
SMILES |
OC1C(C2=CC=CC=C2)(C(OCCOCCN(CC)CC)=O)CCC1 |
SPLASH |
splash10-000i-9400000000-463e0a776e3cad26783f |
Sample Comments |
Hydroxyl position uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Carbetapentane-M (OH) II
2-(2-(diethylamino)ethoxy)ethyl 2-hydroxy-1-phenylcyclopentane-1-carboxylate |
Technique |
GC/MS |
Wiley ID |
DD2024_013495 |