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4-Chlorophenylisocyanate
SpectraBase Compound ID 6CQaKNrMlB
InChI InChI=1S/C7H4ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey ADAKRBAJFHTIEW-UHFFFAOYSA-N
Mol Weight 153.57 g/mol
Molecular Formula C7H4ClNO
Exact Mass 152.998141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2q1hpPCt4D
Name Benzene, 1-chloro-4-isocyanato-
Alternate Name(s) 1-Chloranyl-4-isocyanato-benzene 1-Chloro-4-isocyanato-benzene 4-Chloro-iso-cyanatobenzene 4-Chlorophenyl isocyanate Isocyanic acid, p-chlorophenyl ester p-Chlorfenylisokyanat p-Chlorophenyl isocyanate para-Chlorophenyl isocyanate PCPI EINECS 203-176-9 HSDB 1331 NSC 76589
CAS Registry Number 104-12-1
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Formula C7H4ClNO
InChI InChI=1S/C7H4ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey ADAKRBAJFHTIEW-UHFFFAOYSA-N
Molecular Weight 153.568 g/mol
SMILES c1(N=C=O)ccc(cc1)Cl
SPLASH splash10-004i-4900000000-6512ab0b6cbf1690ad82
Source of Spectrum PG-1982-1311-0
Wiley ID 1150214