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3,5-Dichloro-phenylisocyanate

View entire compound with spectra: 4 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

3,5-Dichloro-phenylisocyanate
SpectraBase Compound ID IqNaLxdbwqe
InChI InChI=1S/C7H3Cl2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H
InChIKey XEFUJGURFLOFAN-UHFFFAOYSA-N
Mol Weight 188.01 g/mol
Molecular Formula C7H3Cl2NO
Exact Mass 186.959169 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K7g2xzihbV
Name 3,5-Dichlorophenyl isocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 389056
CAS Registry Number 34893-92-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl2NO
InChI InChI=1S/C7H3Cl2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H
InChIKey XEFUJGURFLOFAN-UHFFFAOYSA-N
Observed nucleus 13C
Purity 96%
Solvent Acetonitrile-d3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_008485