For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzene, 1,4-diisocyanato-
SpectraBase Compound ID DomgGFZeBJ2
InChI InChI=1S/C8H4N2O2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H
InChIKey ALQLPWJFHRMHIU-UHFFFAOYSA-N
Mol Weight 160.13 g/mol
Molecular Formula C8H4N2O2
Exact Mass 160.027277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4xNvgXhBwGf
Name Benzene, 1,4-diisocyanato-
Alternate Name(s) 1,4-Diisocyanatobenzene 1,4-Benzenediisocyanate p-Phenylene diisocyanate 1,4-Phenylene diisocyanate Isocyanic acid, p-phenylene ester p-Phenylene isocyanate Phenylene-1,4-diisocyanate EINECS 203-207-6 NSC 94776
CAS Registry Number 104-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4N2O2
InChI InChI=1S/C8H4N2O2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H
InChIKey ALQLPWJFHRMHIU-UHFFFAOYSA-N
Molecular Weight 160.132 g/mol
SMILES c1(ccc(cc1)N=C=O)N=C=O
SPLASH splash10-0ik9-4900000000-d7129f0e40937df4aee1
Source of Spectrum JX-2015-6-9856
Wiley ID 1730442