| SpectraBase Spectrum ID |
GW50Ff319P6 |
| Name |
3-Methoxy-benzoic acid hex-2-yl ester |
| Classification |
Pharmaceutical drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
236.141244501 u |
| Formula |
C14H20O3 |
| InChI |
InChI=1S/C14H20O3/c1-4-5-7-11(2)17-14(15)12-8-6-9-13(10-12)16-3/h6,8-11H,4-5,7H2,1-3H3 |
| InChIKey |
NYMKWTLMUJCUTM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
236.311 g/mol |
| Nominal Mass |
236 u |
| Quality |
992 |
| Retention Index |
1729 |
| SMILES |
C=1(C(OC(CCCC)C)=O)C=C(C=CC1)OC |
| SPLASH |
splash10-0udr-3900000000-b37009741a7ddd5b95a1 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
m-Anisic acid 2-hexyl ester
2-Hexyl-m-methoxybenzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015089 |
