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2-Chloro-6-methylphenyl isocyanate

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

2-Chloro-6-methylphenyl isocyanate
SpectraBase Compound ID DxzyceEO7te
InChI InChI=1S/C8H6ClNO/c1-6-3-2-4-7(9)8(6)10-5-11/h2-4H,1H3
InChIKey FBTQQNYGMICJQZ-UHFFFAOYSA-N
Mol Weight 167.59 g/mol
Molecular Formula C8H6ClNO
Exact Mass 167.013792 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 3I2m4PeiaxH
Name 2-Chloro-6-methylphenyl isocyanate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L11645
Lot Number 10151486
CAS Registry Number 40398-01-4
Color Properties Colorless to yellow
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6ClNO
InChI InChI=1S/C8H6ClNO/c1-6-3-2-4-7(9)8(6)10-5-11/h2-4H,1H3
InChIKey FBTQQNYGMICJQZ-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Molecular Weight 167.595 g/mol
Purity 97%
Source of Spectrum Bio-Rad Laboratories, Inc.
Technique ATR-Neat (DuraSamplIR II)