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2,3-Dimethyl-6-nitrophenyl isocyanate

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

2,3-Dimethyl-6-nitrophenyl isocyanate
SpectraBase Compound ID 3YoywLLJIXV
InChI InChI=1S/C9H8N2O3/c1-6-3-4-8(11(13)14)9(7(6)2)10-5-12/h3-4H,1-2H3
InChIKey GCYYCDNYQBZIKN-UHFFFAOYSA-N
Mol Weight 192.17 g/mol
Molecular Formula C9H8N2O3
Exact Mass 192.053492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3IvXzh5igss
Name 2,3-Dimethyl-6-nitrophenyl isocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 512044
CAS Registry Number 302912-25-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O3
InChI InChI=1S/C9H8N2O3/c1-6-3-4-8(11(13)14)9(7(6)2)10-5-12/h3-4H,1-2H3
InChIKey GCYYCDNYQBZIKN-UHFFFAOYSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_010266