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5-Oxohexanenitrile
SpectraBase Compound ID JlzvsncJYFX
InChI InChI=1S/C6H9NO/c1-6(8)4-2-3-5-7/h2-4H2,1H3
InChIKey AEVMBQIIZGKQRB-UHFFFAOYSA-N
Mol Weight 111.14 g/mol
Molecular Formula C6H9NO
Exact Mass 111.068414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6dZDJx2YDfc
Name 5-OXOHEXANENITRILE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 88C/8mm
CAS Registry Number 10412-98-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NO
InChI InChI=1S/C6H9NO/c1-6(8)4-2-3-5-7/h2-4H2,1H3
InChIKey AEVMBQIIZGKQRB-UHFFFAOYSA-N
Molecular Weight 111.14
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms HEXANENITRILE, 5-OXO-,