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2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide
SpectraBase Compound ID 1E0ThjqFfom
InChI InChI=1S/C13H8F3NO2S/c14-13(15,16)9-6-7-12(11(8-9)17(18)19)20-10-4-2-1-3-5-10/h1-8H
InChIKey UBCNQWMQLBEUOC-UHFFFAOYSA-N
Mol Weight 299.27 g/mol
Molecular Formula C13H8F3NO2S
Exact Mass 299.022784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tP6zdFD5n1
Name 2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide
Alternate Name(s) 2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene 2-Nitro-1-phenylsulfanyl-4-(trifluoromethyl)benzene Benzene, 1-trifluoromethyl-3-nitro-4-phenylthio- Benzene, 2-nitro-1-(phenylthio)-4-(trifluoromethyl)- EINECS 206-470-5
CAS Registry Number 346-44-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8F3NO2S
InChI InChI=1S/C13H8F3NO2S/c14-13(15,16)9-6-7-12(11(8-9)17(18)19)20-10-4-2-1-3-5-10/h1-8H
InChIKey UBCNQWMQLBEUOC-UHFFFAOYSA-N
Molecular Weight 299.267 g/mol
SMILES c1(N(=O)=O)c(Sc2ccccc2)ccc(C(F)(F)F)c1
SPLASH splash10-00p0-9770000000-db3ed9754bf71dfbad94
Wiley ID 1455892