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1,3-Phenylene diisocyanate
SpectraBase Compound ID EqEAtvSS1RT
InChI InChI=1S/C8H4N2O2/c11-5-9-7-2-1-3-8(4-7)10-6-12/h1-4H
InChIKey VGHSXKTVMPXHNG-UHFFFAOYSA-N
Mol Weight 160.13 g/mol
Molecular Formula C8H4N2O2
Exact Mass 160.027277 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4YDrsgQy7Me
Name 1,3-Phenylene diisocyanate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L04642
Lot Number 10157459
CAS Registry Number 123-61-5
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Formula C8H4N2O2
InChI InChI=1S/C8H4N2O2/c11-5-9-7-2-1-3-8(4-7)10-6-12/h1-4H
InChIKey VGHSXKTVMPXHNG-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Physical State Solid
Purity 96%
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Synonyms Benzene 1,3-diisocyanate
Technique KBr0