For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Phenylcyclopentanecarboxylicacid 2-hydroxyethylester
SpectraBase Compound ID 6pUYxRDqQib
InChI InChI=1S/C14H18O3/c15-10-11-17-13(16)14(8-4-5-9-14)12-6-2-1-3-7-12/h1-3,6-7,15H,4-5,8-11H2
InChIKey ITWOUJYYXNOJEX-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JJZmrfLyTGS
Name 1-Phenylcyclopentanecarboxylicacid 2-hydroxyethylester
Classification Pharmaceutical drug metabolite
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 234.125594437 u
Formula C14H18O3
InChI InChI=1S/C14H18O3/c15-10-11-17-13(16)14(8-4-5-9-14)12-6-2-1-3-7-12/h1-3,6-7,15H,4-5,8-11H2
InChIKey ITWOUJYYXNOJEX-UHFFFAOYSA-N
Ionization Type Chemical Ionization (CI)
Molecular Weight 234.295 g/mol
Nominal Mass 234 u
Reagent Gas Methane
Retention Index 1754
SMILES OCCOC(C1(C2=CC=CC=C2)CCCC1)=O
SPLASH splash10-0002-0910000000-ba7abae80007a258fdc9
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Carbetapentane-M (hydroxyethyl ester) Pentoxyverine-M (hyroxyethyl ester) 2-hydroxyethyl 1-phenylcyclopentane-1-carboxylate
Technique GC/MS
Wiley ID DD2024_013510