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2-Chloranyl-3-phenylsulfanyl-cyclohepta-1,3-diene
SpectraBase Compound ID FU0FjcUb8MJ
InChI InChI=1S/C13H13ClS/c14-12-9-5-2-6-10-13(12)15-11-7-3-1-4-8-11/h1,3-4,7-10H,2,5-6H2
InChIKey RRUSWRLEECPIKO-UHFFFAOYSA-N
Mol Weight 236.76 g/mol
Molecular Formula C13H13ClS
Exact Mass 236.042649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLfGhwPhUiU
Name 2-Chloranyl-3-phenylsulfanyl-cyclohepta-1,3-diene
Alternate Name(s) 2-Chloro-3-(phenylthio)cyclohepta-1,3-diene 2-Chloro-3-phenylsulfanyl-cyclohepta-1,3-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClS
InChI InChI=1S/C13H13ClS/c14-12-9-5-2-6-10-13(12)15-11-7-3-1-4-8-11/h1,3-4,7-10H,2,5-6H2
InChIKey RRUSWRLEECPIKO-UHFFFAOYSA-N
Molecular Weight 236.760 g/mol
SMILES C=1(C(=CCCCC1)Cl)Sc1ccccc1
SPLASH splash10-000l-7190000000-28b4516cb3638e3ead33
Source of Spectrum SK-22-2050-10
Wiley ID 852038