| SpectraBase Spectrum ID |
JIW4jTkhBRY |
| Name |
Methyl 4-ethylbenzoate |
| CAS Registry Number |
7364-20-7 |
| 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 |
164.083729624 u |
| Formula |
C10H12O2 |
| InChI |
InChI=1S/C10H12O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h4-7H,3H2,1-2H3 |
| InChIKey |
CAABRJFUDNBRJZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
164.204 g/mol |
| Nominal Mass |
164 u |
| Quality |
1000 |
| Retention Index |
1289 |
| SMILES |
C=1(C(OC)=O)C=CC(=CC1)CC |
| SPLASH |
splash10-001i-3900000000-6d6af219edce9371844e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-Ethylbenzoic acid methyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024660 |
