| SpectraBase Spectrum ID |
ReGug98VPy |
| Name |
(R,E)-(1,1,1-Trifluorodec-2-en-4-yl)(trifluoromethyl)sulfane |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.087690667 u |
| Formula |
C11H16F6S |
| InChI |
InChI=1S/C11H16F6S/c1-2-3-4-5-6-9(18-11(15,16)17)7-8-10(12,13)14/h7-9H,2-6H2,1H3/b8-7+/t9-/m1/s1 |
| InChIKey |
IUUUOBUJHKNKIC-FCZSHJHJSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202210509 |
| Molecular Weight |
294.299 g/mol |
| Optical Rotation |
[a]D25 = -16 (c = 0.1, CHCl3) |
| Quality |
218 |
| SMILES |
[C@@](\C=C\C(F)(F)F)(CCCCCC)(SC(F)(F)F)[H] |
| SPLASH |
splash10-0006-9320000000-a4f0eb4240f6b59dea9a |
| Sample Comments |
98% ee |
| Source of Spectrum |
ACI-61-SM15-3a (DOI: 10.1002/anie.202210509) |
| Wiley ID |
1899607 |
