| SpectraBase Spectrum ID |
Ln5mVbBfQxO |
| Name |
.alpha.-(Trifluoromethyl)benzyl-1,3-dithiane |
| Alternate Name(s) |
2-(2,2,2-trifluoro-1-phenylethyl)-1,3-dithiane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13F3S2 |
| InChI |
InChI=1S/C12H13F3S2/c13-12(14,15)10(9-5-2-1-3-6-9)11-16-7-4-8-17-11/h1-3,5-6,10-11H,4,7-8H2 |
| InChIKey |
JEKPXCVJNRAVEU-UHFFFAOYSA-N |
| Molecular Weight |
278.351 g/mol |
| SMILES |
C1(SCCCS1)C(c1ccccc1)C(F)(F)F |
| SPLASH |
splash10-00di-0930000000-474b7f665df82ed3a32e |
| Source of Spectrum |
SO-0-967-5 |
| Wiley ID |
1543622 |
