| SpectraBase Spectrum ID |
I53FHj1f34f |
| Name |
(2SR,3SR,4RS)-3-Acetoxy-2-p-tolylsulfanyl-4-trifluoroacetoxy-2-trifluoromethyl-3,4-dihydro-2H-thiopyran |
| Appearance |
Pale brown crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
460.023770253 u |
| Formula |
C17H14F6O4S2 |
| InChI |
InChI=1S/C17H14F6O4S2/c1-9-3-5-11(6-4-9)29-15(17(21,22)23)13(26-10(2)24)12(7-8-28-15)27-14(25)16(18,19)20/h3-8,12-13H,1-2H3/t12-,13+,15+/m1/s1 |
| InChIKey |
AFACJVOCFCLZPV-IPYPFGDCSA-N |
| Instrument Name |
Hewlett-Packard 5890/5972 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800643 |
| Molecular Weight |
460.405 g/mol |
| Quality |
134 |
| SMILES |
[C@]1([C@@](C=CS[C@]1(C(F)(F)F)SC1=CC=C(C=C1)C)(OC(=O)C(F)(F)F)[H])(OC(C)=O)[H] |
| SPLASH |
splash10-007o-6900000000-ec1a766779977b1919af |
| Source of Spectrum |
K1-2018-5579-4a (DOI: 10.1002/ejoc.201800643) |
| Wiley ID |
1894350 |
