For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-5-Ethyl-1,1,1-trifluoro-3-(p-tolylthio)hept-2-en-4-ol
SpectraBase Compound ID JavaFgX5iS0
InChI InChI=1S/C16H21F3OS/c1-4-12(5-2)15(20)14(10-16(17,18)19)21-13-8-6-11(3)7-9-13/h6-10,12,15,20H,4-5H2,1-3H3/b14-10+
InChIKey LXCRGAFZZMUPSY-GXDHUFHOSA-N
Mol Weight 318.4 g/mol
Molecular Formula C16H21F3OS
Exact Mass 318.126521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6EGmtkZ7Tgx
Name (E)-5-Ethyl-1,1,1-trifluoro-3-(p-tolylthio)hept-2-en-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21F3OS
InChI InChI=1S/C16H21F3OS/c1-4-12(5-2)15(20)14(10-16(17,18)19)21-13-8-6-11(3)7-9-13/h6-10,12,15,20H,4-5H2,1-3H3/b14-10+
InChIKey LXCRGAFZZMUPSY-GXDHUFHOSA-N
Molecular Weight 318.398 g/mol
SMILES OC(\C(=C/C(F)(F)F)Sc1ccc(cc1)C)C(CC)CC
SPLASH splash10-00dl-8900000000-98c602d5d2eecea0ab9e
Source of Spectrum F-65-2762-4ak
Synonyms (E)-5-ethyl-1,1,1-trifluoro-3-[(4-methylphenyl)thio]-2-hepten-4-ol (E)-5-ethyl-1,1,1-trifluoro-3-(4-methylphenyl)sulfanylhept-2-en-4-ol (E)-5-ethyl-1,1,1-trifluoro-3-(p-tolylsulfanyl)hept-2-en-4-ol
Wiley ID 1681260