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(E)-1-cyclohexyl-2-hepten-1-one
SpectraBase Compound ID 4jXcZv7dfmk
InChI InChI=1S/C13H22O/c1-2-3-4-8-11-13(14)12-9-6-5-7-10-12/h8,11-12H,2-7,9-10H2,1H3/b11-8+
InChIKey KNEMPSNKYMYAQI-DHZHZOJOSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyvDA5Bp5Bp
Name (E)-1-cyclohexyl-2-hepten-1-one
CAS Registry Number 111036-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-2-3-4-8-11-13(14)12-9-6-5-7-10-12/h8,11-12H,2-7,9-10H2,1H3/b11-8+
InChIKey KNEMPSNKYMYAQI-DHZHZOJOSA-N
Molecular Weight 194.318 g/mol
SMILES C(\C=C\CCCC)(=O)C1CCCCC1
SPLASH splash10-03dr-0900000000-8677baabd85d216e00ba
Source of Spectrum AJ-60-1845-28
Synonyms (E)-1-cyclohexylhept-2-en-1-one
Wiley ID 1191504