| SpectraBase Spectrum ID |
DmT2gRnegIC |
| Name |
2-Methoxy-benzoic acid butyl ester |
| CAS Registry Number |
2364-62-7 |
| Classification |
Chemical |
| 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/c1-3-4-9-15-12(13)10-7-5-6-8-11(10)14-2/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
PEPUAWXAGBAMGU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
208.257 g/mol |
| Nominal Mass |
208 u |
| Quality |
978 |
| Retention Index |
1600 |
| SMILES |
C=1(C(=CC=CC1)OC)C(OCCCC)=O |
| SPLASH |
splash10-000i-2900000000-b437095d36b7ac854ecb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzoic acid,2-methoxy-,butyl ester
Butyl-2-methoxy benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015035 |
