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(4-Chlorostyryl)(phenyl)sulfane
SpectraBase Compound ID JJBHNPStu2A
InChI InChI=1S/C14H11ClS/c15-13-8-6-12(7-9-13)10-11-16-14-4-2-1-3-5-14/h1-11H/b11-10+
InChIKey LYORDQHVEBYVMV-ZHACJKMWSA-N
Mol Weight 246.75 g/mol
Molecular Formula C14H11ClS
Exact Mass 246.026999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GMReUVtHCgl
Name (4-Chlorostyryl)(phenyl)sulfane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.026999228 u
Formula C14H11ClS
InChI InChI=1S/C14H11ClS/c15-13-8-6-12(7-9-13)10-11-16-14-4-2-1-3-5-14/h1-11H/b11-10+
InChIKey LYORDQHVEBYVMV-ZHACJKMWSA-N
Molecular Weight 246.755 g/mol
SMILES C1(\C=C\SC2=CC=CC=C2)=CC=C(C=C1)Cl