| SpectraBase Spectrum ID |
DoBrgjJBXsm |
| Name |
Acetic acid 2-methylphenyl ester |
| CAS Registry Number |
533-18-6 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
150.068079560 u |
| Formula |
C9H10O2 |
| InChI |
InChI=1S/C9H10O2/c1-7-5-3-4-6-9(7)11-8(2)10/h3-6H,1-2H3 |
| InChIKey |
AMZORBZSQRUXNC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
150.177 g/mol |
| Nominal Mass |
150 u |
| Quality |
980 |
| Retention Index |
1091 |
| SMILES |
C1(=C(C=CC=C1)C)OC(=O)C |
| SPLASH |
splash10-0a4i-3900000000-7019905302195bb30b67 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-methylphenyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006857 |
