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2-Butanone, 4-(2-ethylidenecyclohexyl)-
SpectraBase Compound ID GxZ2trn5WGL
InChI InChI=1S/C12H20O/c1-3-11-6-4-5-7-12(11)9-8-10(2)13/h3,12H,4-9H2,1-2H3/b11-3+
InChIKey LXVVBGSWKFRBMK-QDEBKDIKSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3XTLZJeUf4
Name 2-Butanone, 4-(2-ethylidenecyclohexyl)-
Alternate Name(s) 4-(1-Ethylidenecyclohex-2-yl)-2-butanone 4-[(2E)-2-ethylidenecyclohexyl]-2-butanone
CAS Registry Number 96165-23-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-3-11-6-4-5-7-12(11)9-8-10(2)13/h3,12H,4-9H2,1-2H3/b11-3+
InChIKey LXVVBGSWKFRBMK-QDEBKDIKSA-N
Molecular Weight 180.291 g/mol
SMILES C1(\C(CCCC1)=C\C)CCC(=O)C
SPLASH splash10-00di-0900000000-204a189595b1f883898d
Source of Spectrum J-50-1955-3
Wiley ID 1176905