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2,4,6-Trichlorophenyl isothiocyanate
SpectraBase Compound ID IBYESIgVxHQ
InChI InChI=1S/C7H2Cl3NS/c8-4-1-5(9)7(11-3-12)6(10)2-4/h1-2H
InChIKey DSXVZIOQROMOEF-UHFFFAOYSA-N
Mol Weight 238.52 g/mol
Molecular Formula C7H2Cl3NS
Exact Mass 236.897353 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 79xlcWmwozJ
Name 2,4,6-Trichlorophenyl isothiocyanate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L12118
Lot Number 10121853
CAS Registry Number 22134-07-2
Color Properties Pale cream to Pale yellow
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Formula C7H2Cl3NS
InChI InChI=1S/C7H2Cl3NS/c8-4-1-5(9)7(11-3-12)6(10)2-4/h1-2H
InChIKey DSXVZIOQROMOEF-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Physical State Solid
Purity 98%
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms 1,3,5-Trichloro-2-isothiocyanatobenzene
Technique ATR-Neat (DuraSamplIR II)