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2,4-Dimethylphenyl isocyanate

View entire compound with spectra: 2 NMR, 3 FTIR, and 1 Raman

2,4-Dimethylphenyl isocyanate
SpectraBase Compound ID FOqFVLtx7Tu
InChI InChI=1S/C9H9NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-5H,1-2H3
InChIKey QUOBVYPFBJUOAJ-UHFFFAOYSA-N
Mol Weight 147.18 g/mol
Molecular Formula C9H9NO
Exact Mass 147.068414 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID JVjQXznZOYs
Name 2,4-Dimethylphenyl isocyanate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L11126
Lot Number 10184145
CAS Registry Number 51163-29-2
Color Properties Colorless
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO
IUPAC Name 1-isocyanato-2,4-dimethylbenzene
InChI InChI=1S/C9H9NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-5H,1-2H3
InChIKey QUOBVYPFBJUOAJ-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Purity 98+%
Source of Spectrum Bio-Rad Laboratories, Inc.
Technique ATR-Neat (DuraSamplIR II)