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2-((2-Chlorophenyl)thio)benzo[d]thiazole
SpectraBase Compound ID 4lXRx71XJdk
InChI InChI=1S/C13H8ClNS2/c14-9-5-1-3-7-11(9)16-13-15-10-6-2-4-8-12(10)17-13/h1-8H
InChIKey UNGVMFFINJFURC-UHFFFAOYSA-N
Mol Weight 277.79 g/mol
Molecular Formula C13H8ClNS2
Exact Mass 276.978669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KanvKqCrxT
Name 2-((2-Chlorophenyl)thio)benzo[d]thiazole
Appearance oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8ClNS2
InChI InChI=1S/C13H8ClNS2/c14-9-5-1-3-7-11(9)16-13-15-10-6-2-4-8-12(10)17-13/h1-8H
InChIKey UNGVMFFINJFURC-UHFFFAOYSA-N
Instrument Name Bruker Scion 460-GC or Agilent 8860 GC-5977B GC/MSD
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202200961
Molecular Weight 277.787 g/mol
SMILES c1(Cl)c(cccc1)Sc1sc2c(n1)cccc2
SPLASH splash10-0006-0090000000-1a136d667ac70986f0e6
Source of Spectrum CCC-14-SM15-9c
Wiley ID 1876197