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Benzyl 5-chloro-2-nitrophenyl sulfide
SpectraBase Compound ID 5kFdmEIpCM1
InChI InChI=1S/C13H10ClNO2S/c14-11-6-7-12(15(16)17)13(8-11)18-9-10-4-2-1-3-5-10/h1-8H,9H2
InChIKey YGVHUHUCUDNMJS-UHFFFAOYSA-N
Mol Weight 279.74 g/mol
Molecular Formula C13H10ClNO2S
Exact Mass 279.012077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBAait8OSph
Name Benzyl 5-chloro-2-nitrophenyl sulfide
CAS Registry Number 69741-45-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10ClNO2S
InChI InChI=1S/C13H10ClNO2S/c14-11-6-7-12(15(16)17)13(8-11)18-9-10-4-2-1-3-5-10/h1-8H,9H2
InChIKey YGVHUHUCUDNMJS-UHFFFAOYSA-N
Molecular Weight 279.741 g/mol
SMILES c1cc(N(=O)=O)c(cc1Cl)SCc1ccccc1
SPLASH splash10-0006-9100000000-2b98db8e7566a2513b95
Source of Spectrum NP-8-8378-0
Synonyms 2-Benzylthio-4-chloronitrobenzene 4-Chloro-1-nitro-2-(phenylmethylthio)benzene 2-Benzylsulfanyl-4-chloro-1-nitrobenzene 2-Benzylsulfanyl-4-chloro-1-nitro-benzene 4-Chloranyl-1-nitro-2-(phenylmethylsulfanyl)benzene
Wiley ID 1107661