| SpectraBase Spectrum ID |
LZOT2Mz4YUZ |
| Name |
Butyl 3,5-bis(trifluoromethyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.074148602 u |
| Formula |
C13H12F6O2 |
| GC Column |
HP-5 |
| InChI |
InChI=1S/C13H12F6O2/c1-2-3-4-21-11(20)8-5-9(12(14,15)16)7-10(6-8)13(17,18)19/h5-7H,2-4H2,1H3 |
| InChIKey |
BHWZORUVVSVLKH-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202003752 |
| Molecular Weight |
314.227 g/mol |
| Quality |
19 |
| SMILES |
C(CCC)OC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)=O |
| SPLASH |
splash10-01ox-0090000000-74d6d1667cd1e51efb30 |
| Source of Spectrum |
QE-27-SM36-2i (DOI: 10.1002/chem.202003752) |
| Wiley ID |
1903989 |
