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2-Cyclohexene-1-hexanenitrile, .gamma.-oxo-
SpectraBase Compound ID HUPran4GHI4
InChI InChI=1S/C12H17NO/c13-10-4-7-12(14)9-8-11-5-2-1-3-6-11/h2,5,11H,1,3-4,6-9H2
InChIKey FPZOBKVAGBTWTF-UHFFFAOYSA-N
Mol Weight 191.27 g/mol
Molecular Formula C12H17NO
Exact Mass 191.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHyRs6R6aeK
Name 2-Cyclohexene-1-hexanenitrile, .gamma.-oxo-
Alternate Name(s) 6-(2'-Cyclohexenyl)-4-oxohexanenitrile 6-(2-cyclohexen-1-yl)-4-oxohexanenitrile
CAS Registry Number 126790-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO
InChI InChI=1S/C12H17NO/c13-10-4-7-12(14)9-8-11-5-2-1-3-6-11/h2,5,11H,1,3-4,6-9H2
InChIKey FPZOBKVAGBTWTF-UHFFFAOYSA-N
Molecular Weight 191.274 g/mol
SMILES C(#N)CCC(=O)CCC1C=CCCC1
SPLASH splash10-004l-9000000000-4c94bbf32d7e45166421
Source of Spectrum C-112-4007-12
Wiley ID 1187708