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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2xTdMGnv8q
Name 2,4-Dichlorophenyl isothiocyanate
CAS Registry Number 6590-96-1
Copyright Copyright © 2020-2024 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
Molecular Weight 204.074 g/mol
SMILES c1(Cl)cc(c(cc1)N=C=S)Cl
SPLASH splash10-0zfr-5690000000-7432938029345928004f
Synonyms 2,4-bis(chloranyl)-1-isothiocyanato-benzene 2,4-Dichloro-1-isothiocyanato-benzene Benzene, 2,4-dichloro-1-isothiocyanato-
Wiley ID 1482752