| SpectraBase Spectrum ID |
B1TtYgLfjAO |
| Name |
1-Phenylcyclopentanecarboxylic acid |
| CAS Registry Number |
77-55-4 |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
190.099379689 u |
| Formula |
C12H14O2 |
| InChI |
InChI=1S/C12H14O2/c13-11(14)12(8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,13,14) |
| InChIKey |
RHPCYZLXNNRRMB-UHFFFAOYSA-N |
| Ionization Type |
Chemical Ionization (CI) |
| Molecular Weight |
190.242 g/mol |
| Nominal Mass |
190 u |
| Reagent Gas |
Methane |
| Retention Index |
1611 |
| SMILES |
OC(C1(C2=CC=CC=C2)CCCC1)=O |
| SPLASH |
splash10-0007-0900000000-f7e0e6692413abff888c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Carbetapentane-M (carboxy)
Pentoxyverine-M (carboxy)
1-phenylcyclopentane-1-carboxylic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013506 |
