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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lWClkclXdH
Name 5-Oxohexanenitrile
CAS Registry Number 10412-98-3
Copyright Copyright © 2020-2024 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 111.144 g/mol
SMILES C(=O)(CCCC#N)C
SPLASH splash10-0006-9000000000-3e26bcc34c34387cccb1
Source of Spectrum RB-1982-16351-0
Synonyms 5-Ketohexanenitrile 5-Oxidanylidenehexanenitrile Hexanenitrile, 5-oxo-
Wiley ID 1122818