| SpectraBase Spectrum ID |
8I8D52pombg |
| Name |
2-Methoxy-benzoic acid 2-pentyl ester |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.125594437 u |
| Formula |
C13H18O3 |
| InChI |
InChI=1S/C13H18O3/c1-4-7-10(2)16-13(14)11-8-5-6-9-12(11)15-3/h5-6,8-10H,4,7H2,1-3H3 |
| InChIKey |
FUTSWRDYJGZWEO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.284 g/mol |
| Nominal Mass |
222 u |
| Quality |
994 |
| Retention Index |
1614 |
| SMILES |
C=1(C(=CC=CC1)OC)C(OC(CCC)C)=O |
| SPLASH |
splash10-000i-3900000000-bb66d4e7aac12064e59e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
pentan-2-yl 2-methoxybenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015050 |
