| SpectraBase Spectrum ID |
82eLuwZEOo5 |
| Name |
1-Methyl-4-(3,3,3-trifluoro-1-phenylprop-1-en-2-yl)benzene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.096934908 u |
| Formula |
C16H13F3 |
| GC Column |
HP-5 MS (30 m x 250 micrometer, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C16H13F3/c1-12-7-9-14(10-8-12)15(16(17,18)19)11-13-5-3-2-4-6-13/h2-11H,1H3 |
| InChIKey |
LWGXDRGFLPOGGG-UHFFFAOYSA-N |
| Instrument Name |
Agilent 7890B GC-5977B MSD |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/adsc.202300491 |
| Molecular Weight |
262.275 g/mol |
| Quality |
914 |
| Reported Formula |
C16H13F3 |
| SMILES |
C(=CC1=CC=CC=C1)(C1=CC=C(C=C1)C)C(F)(F)F |
| SPLASH |
splash10-01tc-1890000000-f3d6d3d5e514a21fae68 |
| Sample Comments |
E/Z = 1.3:1 |
| Source of Spectrum |
ASC-365-SM20-2e (DOI: 10.1002/adsc.202300491) |
| Wiley ID |
1909678 |
