Hexamethylene diisocyanate

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Systematic / IUPAC Name: 1,6-Diisocyanatohexane

ID: Reference7312

Other Names: Desmodur H;
1,6-Diisocyanatohexane;
1,6-Hexamethylene diisocyanate;
1,6-Hexane diisocyanate;
1,6-Hexylene diisocyanate ; more

Formula: C8H12N2O2

Class: Extractables/Leachables

Spectral Data

Hexamethylene diisocyanate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 1234
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/28/2018 9:59:01 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C8H12N2O2/c11-7-9-5-3-1-2-4-6-10-8-12/h1-6H2
InChI Key RRAMGCGOFNQTLD-UHFFFAOYSA-N
Canonical SMILES C(CCCN=C=O)CCN=C=O
CAS 822060
Splash
Other Names Desmodur H;
1,6-Diisocyanatohexane;
1,6-Hexamethylene diisocyanate;
1,6-Hexane diisocyanate;
1,6-Hexylene diisocyanate;
Hexamethylene 1,6-diisocyanate;
Hexamethylene di-isocyanate;
Hexamethylene diisocyanate;
Hexamethylene diisocyanate, 1,6-;
Hexamethylene-1,6-diisocyanate;
Hexamethylenediisocyanate;
Hexane 1,6-diisocyanate;
Hexane, 1,6-diisocyanato-;
Hexane,1,6-diisocyanate;
Hexane-1,6-diisocyanate;
Isocyanic acid, hexamethylene ester;
HDI;
HMDI

In Other Databases

ChemIDPlus 000822060; 028574905; 095566420; 123098011
PubChem 13192
ChEBI CHEBI:53578
ChEMBL CHEMBL1896533
Wikipedia Hexamethylene diisocyanate
ChemSpider 12637