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(E)-1-Phenylthio-3,3,3-trifluoroprop-1-ene
SpectraBase Compound ID Jrz4l28NGDb
InChI InChI=1S/C9H7F3S/c10-9(11,12)6-7-13-8-4-2-1-3-5-8/h1-7H/b7-6+
InChIKey IDLBFALETWPANA-VOTSOKGWSA-N
Mol Weight 204.21 g/mol
Molecular Formula C9H7F3S
Exact Mass 204.022056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIqKVUPEANd
Name (E)-1-Phenylthio-3,3,3-trifluoroprop-1-ene
Appearance Yellow oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.022055888 u
Formula C9H7F3S
InChI InChI=1S/C9H7F3S/c10-9(11,12)6-7-13-8-4-2-1-3-5-8/h1-7H/b7-6+
InChIKey IDLBFALETWPANA-VOTSOKGWSA-N
Instrument Name Shimadzu QP2010-Ultra
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/ejoc.201901445
Molecular Weight 204.210 g/mol
Quality 250
Reported Formula C9H7F3S
SMILES C1(=CC=CC=C1)S\C=C\C(F)(F)F
SPLASH splash10-0f79-1960000000-c291f52c8ff5dc12f305
Source of Spectrum K1-2019-SM18-5b (DOI: 10.1002/ejoc.201901445)
Wiley ID 1894512