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thiocyanic acid, 2,6-dichlorobenzyl ester
SpectraBase Compound ID 4ZdJ05XmH2o
InChI InChI=1S/C8H5Cl2NS/c9-7-2-1-3-8(10)6(7)4-12-5-11/h1-3H,4H2
InChIKey IBWINXSTXHFYMY-UHFFFAOYSA-N
Mol Weight 218.1 g/mol
Molecular Formula C8H5Cl2NS
Exact Mass 216.951976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5YS4YS5tezw
Name THIOCYANIC ACID, 2,6-DICHLOROBENZYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5Cl2NS
InChI InChI=1S/C8H5Cl2NS/c9-7-2-1-3-8(10)6(7)4-12-5-11/h1-3H,4H2
InChIKey IBWINXSTXHFYMY-UHFFFAOYSA-N
Melting Point 40-42C
Molecular Weight 268.11
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20