| SpectraBase Spectrum ID |
HIb7i0wPKiA |
| Name |
3-Methoxy-benzoic acid butyl 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 |
208.109944372 u |
| Formula |
C12H16O3 |
| InChI |
InChI=1S/C12H16O3/c1-3-4-8-15-12(13)10-6-5-7-11(9-10)14-2/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey |
BQGRZDUSDFGMHU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
208.257 g/mol |
| Nominal Mass |
208 u |
| Quality |
992 |
| Retention Index |
1594 |
| SMILES |
C=1(C(OCCCC)=O)C=C(C=CC1)OC |
| SPLASH |
splash10-0udr-4900000000-b3fe03b5c762c167a799 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Butyl m-methoxybenzoate
m-Anisic acid butyl ester
Butyl-3-methoxy benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015071 |
