| SpectraBase Spectrum ID |
L0n4qwOj8wc |
| Name |
2-Allyl-5-(trifluoromethyl)benzoic acid |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
230.055464017 u |
| Formula |
C11H9F3O2 |
| InChI |
InChI=1S/C11H9F3O2/c1-2-3-7-4-5-8(11(12,13)14)6-9(7)10(15)16/h2,4-6H,1,3H2,(H,15,16) |
| InChIKey |
ZNXZBPFAKCKDCX-UHFFFAOYSA-N |
| Instrument Name |
Waters GCT Premier CAB163 |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/anie.201712520 |
| Molecular Weight |
230.186 g/mol |
| Quality |
194 |
| Reported Formula |
C11H9F3O2 |
| SMILES |
OC(C1=C(CC=C)C=CC(=C1)C(F)(F)F)=O |
| SPLASH |
splash10-014i-0590000000-5f365c32fdf28defc560 |
| Source of Spectrum |
ACI-57-SM11-3ka (DOI: 10.1002/anie.201712520) |
| Wiley ID |
1893527 |
