| SpectraBase Spectrum ID |
GZ7EeM8UHvU |
| Name |
2-Propenoic acid 2-phenylethyl ester |
| CAS Registry Number |
3530-36-7 |
| 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 |
160.088815005 u |
| Formula |
C11H12O |
| InChI |
InChI=1S/C11H12O/c1-2-11(12)9-8-10-6-4-3-5-7-10/h2-7H,1,8-9H2 |
| InChIKey |
XEXCAMXTHVBPBO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
160.216 g/mol |
| Nominal Mass |
160 u |
| Quality |
984 |
| Retention Index |
1295 |
| SMILES |
C=1(CCC(C=C)=O)C=CC=CC1 |
| SPLASH |
splash10-0zfr-9600000000-8ee6dfaca3ec88f060b6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-phenylpent-1-en-3-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_008252 |
