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1-(difluoromethyl)but-3-enylsulfanylmethylbenzene
SpectraBase Compound ID 933BYQK3yDk
InChI InChI=1S/C12H14F2S/c1-2-6-11(12(13)14)15-9-10-7-4-3-5-8-10/h2-5,7-8,11-12H,1,6,9H2
InChIKey SIYVLNDTTNJPCH-UHFFFAOYSA-N
Mol Weight 228.3 g/mol
Molecular Formula C12H14F2S
Exact Mass 228.078428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 672MgQIQz3
Name 1-(difluoromethyl)but-3-enylsulfanylmethylbenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14F2S
InChI InChI=1S/C12H14F2S/c1-2-6-11(12(13)14)15-9-10-7-4-3-5-8-10/h2-5,7-8,11-12H,1,6,9H2
InChIKey SIYVLNDTTNJPCH-UHFFFAOYSA-N
Instrument Name TSQ 8000 Evo
Ionization Type EI
Literature Reference DOI 10.1002/anie.202000119
Molecular Weight 228.301 g/mol
SMILES C(SC(CC=C)C(F)F)c1ccccc1
SPLASH splash10-0006-9100000000-94348857e917ded6c24e
Source of Spectrum ACI-59-SM63-6m
Wiley ID 1857725