| SpectraBase Spectrum ID |
BToQac7pcO7 |
| Name |
3-Phenyl-2-propenoic acid |
| CAS Registry Number |
621-82-9 |
| 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 |
148.052429496 u |
| Formula |
C9H8O2 |
| InChI |
InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+ |
| InChIKey |
WBYWAXJHAXSJNI-VOTSOKGWSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
148.161 g/mol |
| Nominal Mass |
148 u |
| Quality |
998 |
| Retention Index |
1079 |
| SMILES |
OC(\C=C\C1=CC=CC=C1)=O |
| SPLASH |
splash10-0f6t-6900000000-479c4504c3f9540fda14 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Propenoic acid,3-phenyl
2-Propenoic acid,3-phenyl-
3-phenylprop-2-enoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013331 |
