SpectraBase Spectrum ID |
JEfAAiNTH0q |
Name |
Pentoxyverine-M (-C2H5,-2H) |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
303.183443666 u |
Formula |
C18H25NO3 |
InChI |
InChI=1S/C18H25NO3/c1-2-19-12-13-21-14-15-22-17(20)18(10-6-7-11-18)16-8-4-3-5-9-16/h3-6,8-10,19H,2,7,11-15H2,1H3 |
InChIKey |
HMHMVSSODYZDPZ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
303.402 g/mol |
Nominal Mass |
303 u |
Quality |
999 |
Retention Index |
2163 |
SMILES |
C1(C2=CC=CC=C2)(C(OCCOCCNCC)=O)C=CCC1 |
SPLASH |
splash10-0a4i-9500000000-b0e98380bf2409e0cf1b |
Sample Comments |
Double bond position uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Carbetapentane-M (-C2H5,-2H)
2-(2-(ethylamino)ethoxy)ethyl 1-phenylcyclopent-2-ene-1-carboxylate |
Technique |
GC/MS |
Wiley ID |
DD2024_013488 |