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Isothiocyanic acid, 2,4-dichlorophenyl ester

View entire compound with spectra: 3 NMR, 1 FTIR, and 2 MS (GC)

Isothiocyanic acid, 2,4-dichlorophenyl ester
SpectraBase Compound ID FDAh2Nlk6GP
InChI InChI=1S/C7H3Cl2NS/c8-5-1-2-7(10-4-11)6(9)3-5/h1-3H
InChIKey WVBNZZHGECFCSH-UHFFFAOYSA-N
Mol Weight 204.07 g/mol
Molecular Formula C7H3Cl2NS
Exact Mass 202.936326 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7lC5eHQPg6T
Name ISOTHIOCYANIC ACID, 2,4-DICHLOROPHENYL ESTER
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 6590-96-1
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl2NS
InChI InChI=1S/C7H3Cl2NS/c8-5-1-2-7(10-4-11)6(9)3-5/h1-3H
InChIKey WVBNZZHGECFCSH-UHFFFAOYSA-N
Melting Point 36-40C
Molecular Weight 204.08
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ISOTHIOCYANIC ACID, 2,4-DICHLOROPHENYL ESTER