| SpectraBase Spectrum ID |
9QcS30drrGa |
| Name |
2-Acetyl-6-allyl-benzoic acid |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.078644243 u |
| Formula |
C12H12O3 |
| InChI |
InChI=1S/C12H12O3/c1-3-5-9-6-4-7-10(8(2)13)11(9)12(14)15/h3-4,6-7H,1,5H2,2H3,(H,14,15) |
| InChIKey |
JSDLVRGPILUDOG-UHFFFAOYSA-N |
| Instrument Name |
Waters GCT Premier CAB163 |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/anie.201712520 |
| Molecular Weight |
204.225 g/mol |
| Quality |
163 |
| Reported Formula |
C12H12O3 |
| SMILES |
OC(C1=C(C(C)=O)C=CC=C1CC=C)=O |
| SPLASH |
splash10-0109-0900000000-035a1c51bc6fc0e8d3d8 |
| Source of Spectrum |
ACI-57-SM10-3ia (DOI: 10.1002/anie.201712520) |
| Wiley ID |
1893525 |
