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1-[(E)-5-(phenylthio)pent-2-enyl]-3-(trifluoromethyl)benzene
SpectraBase Compound ID EhxhYdjzDce
InChI InChI=1S/C18H17F3S/c19-18(20,21)16-10-7-9-15(14-16)8-3-2-6-13-22-17-11-4-1-5-12-17/h1-5,7,9-12,14H,6,8,13H2/b3-2+
InChIKey XYMIGGQOTCVVTP-NSCUHMNNSA-N
Mol Weight 322.39 g/mol
Molecular Formula C18H17F3S
Exact Mass 322.100306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCKOifqOyo9
Name 1-[(E)-5-(phenylthio)pent-2-enyl]-3-(trifluoromethyl)benzene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17F3S
InChI InChI=1S/C18H17F3S/c19-18(20,21)16-10-7-9-15(14-16)8-3-2-6-13-22-17-11-4-1-5-12-17/h1-5,7,9-12,14H,6,8,13H2/b3-2+
InChIKey XYMIGGQOTCVVTP-NSCUHMNNSA-N
Molecular Weight 322.389 g/mol
SMILES C(c1cc(C\C=C\CCSc2ccccc2)ccc1)(F)(F)F
SPLASH splash10-00di-0912000000-affe768b897584ab9d94
Source of Spectrum F-52-7275-7
Synonyms 1-[(E)-5-phenylsulfanylpent-2-enyl]-3-(trifluoromethyl)benzene
Wiley ID 796614