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4-Nitrophenyl isocyanate
SpectraBase Compound ID BqvC0mP2DZb
InChI InChI=1S/C7H4N2O3/c10-5-8-6-1-3-7(4-2-6)9(11)12/h1-4H
InChIKey GFNKTLQTQSALEJ-UHFFFAOYSA-N
Mol Weight 164.12 g/mol
Molecular Formula C7H4N2O3
Exact Mass 164.022192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGYoXp7CnrH
Name Benzene, 1-isocyanato-4-nitro-
CAS Registry Number 100-28-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4N2O3
InChI InChI=1S/C7H4N2O3/c10-5-8-6-1-3-7(4-2-6)9(11)12/h1-4H
InChIKey GFNKTLQTQSALEJ-UHFFFAOYSA-N
Molecular Weight 164.120 g/mol
SMILES c1(N(=O)=O)ccc(N=C=O)cc1
SPLASH splash10-03di-6900000000-94cdee4e3f2ec6735cf7
Source of Spectrum IC-304-0-0
Synonyms 1-Isocyanato-4-nitro-benzene 4-Nitrophenyl isocyanate Isocyanic acid, p-nitrophenyl ester p-Nitrophenyl isocyanate AI3-28253 EINECS 202-836-3 NSC 9800
Wiley ID 1159867