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isothiocyanic acid, 3-chloro-p-tolyl ester
SpectraBase Compound ID EYFplQqR2zn
InChI InChI=1S/C8H6ClNS/c1-6-2-3-7(10-5-11)4-8(6)9/h2-4H,1H3
InChIKey PQLHTYDGCDDPNU-UHFFFAOYSA-N
Mol Weight 183.66 g/mol
Molecular Formula C8H6ClNS
Exact Mass 182.990948 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JC2mAAjROui
Name ISOTHIOCYANIC ACID, 3-CHLORO-p-TOLYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6ClNS
InChI InChI=1S/C8H6ClNS/c1-6-2-3-7(10-5-11)4-8(6)9/h2-4H,1H3
InChIKey PQLHTYDGCDDPNU-UHFFFAOYSA-N
Molecular Weight 183.66
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ISOTHIOCYANIC ACID, 3-CHLORO-P- TOLYL ESTER