| SpectraBase Spectrum ID |
2pXgQiJWMxk |
| Name |
Allyl-p-toluate |
| CAS Registry Number |
2653-46-5 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
176.083729624 u |
| Formula |
C11H12O2 |
| InChI |
InChI=1S/C11H12O2/c1-3-8-13-11(12)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3 |
| InChIKey |
GGJIQHHMXJIVPF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
176.215 g/mol |
| Nominal Mass |
176 u |
| Quality |
991 |
| Retention Index |
1351 |
| SMILES |
C=1(C(OCC=C)=O)C=CC(=CC1)C |
| SPLASH |
splash10-014i-8900000000-69fd37a1dfb0e604e91a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Allyl 4-methylbenzoate
Allyl-4-methylbenzoate
p-Toluic acid,allyl ester
Prop-2-enyl-4-methyl benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010324 |
