SpectraBase Spectrum ID |
GX4bIpa1xkO |
Name |
Benzyl ethanoate |
CAS Registry Number |
140-11-4 |
Classification |
Flavor |
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/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3 |
InChIKey |
QUKGYYKBILRGFE-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
150.177 g/mol |
Nominal Mass |
150 u |
Quality |
986 |
Retention Index |
1122 |
SMILES |
C=1(COC(=O)C)C=CC=CC1 |
SPLASH |
splash10-0006-9300000000-2af4699b45c184830ebb |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Benzyl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_008373 |