| SpectraBase Spectrum ID |
ATBkJo48TXC |
| Name |
3-Methoxybenzoic acid cyclopentyl ester |
| Classification |
Pharmaceutical drug precursor |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
220.109944372 u |
| Formula |
C13H16O3 |
| InChI |
InChI=1S/C13H16O3/c1-15-12-8-4-5-10(9-12)13(14)16-11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7H2,1H3 |
| InChIKey |
WUVHFFKCMXUFTP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
220.268 g/mol |
| Nominal Mass |
220 u |
| Quality |
983 |
| Retention Index |
1763 |
| SMILES |
C=1(C(OC2CCCC2)=O)C=C(C=CC1)OC |
| SPLASH |
splash10-0f79-4900000000-5013ed14eaf59e6e78dc |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Cyclopentyl m-methoxybenzoate
m-Anisic acid cyclopentyl ester
cyclopentyl 3-methoxybenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015082 |
