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Adiponitrile

View entire compound with spectra: 16 NMR, 9 FTIR, and 14 MS (GC)

Adiponitrile
SpectraBase Compound ID JyWJnpgS2Nc
InChI InChI=1S/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H2
InChIKey BTGRAWJCKBQKAO-UHFFFAOYSA-N
Mol Weight 108.14 g/mol
Molecular Formula C6H8N2
Exact Mass 108.068748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7pB3XVsoyMa
Name ADIPONITRILE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 295C
CAS Registry Number 111-69-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8N2
InChI InChI=1S/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H2
InChIKey BTGRAWJCKBQKAO-UHFFFAOYSA-N
Melting Point 1-3C
Molecular Weight 108.14
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Web Link http://www.cdc.gov/niosh/npg/npgd0015.html