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2,2-Dimethyl-5-oxidanylidene-hexanenitrile
SpectraBase Compound ID C2vrmHUCN1v
InChI InChI=1S/C8H13NO/c1-7(10)4-5-8(2,3)6-9/h4-5H2,1-3H3
InChIKey PWFVILOSFJMIPY-UHFFFAOYSA-N
Mol Weight 139.2 g/mol
Molecular Formula C8H13NO
Exact Mass 139.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPEt5zFnjCe
Name 2,2-Dimethyl-5-oxidanylidene-hexanenitrile
Alternate Name(s) 2,2-Dimethyl-5-oxo-hexanenitrile 5-keto-2,2-dimethyl-hexanenitrile
CAS Registry Number 58422-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO
InChI InChI=1S/C8H13NO/c1-7(10)4-5-8(2,3)6-9/h4-5H2,1-3H3
InChIKey PWFVILOSFJMIPY-UHFFFAOYSA-N
Molecular Weight 139.198 g/mol
SMILES C(#N)C(CCC(=O)C)(C)C
SPLASH splash10-00kf-9000000000-76ed6d4d2b7b41d5bcbe
Source of Spectrum C-99-1540-0
Wiley ID 1138701