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3-((1S,2R)-2-Cyclohexyl-cyclopentylmethyl)-cyclohex-2-enone
SpectraBase Compound ID 9NgtKph8fcb
InChI InChI=1S/C18H28O/c19-17-10-4-6-14(13-17)12-16-9-5-11-18(16)15-7-2-1-3-8-15/h13,15-16,18H,1-12H2/t16-,18+/m0/s1
InChIKey YIZRQWGRIUJQAF-FUHWJXTLSA-N
Mol Weight 260.42 g/mol
Molecular Formula C18H28O
Exact Mass 260.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AW1xVnqyGag
Name 3-((1S,2R)-2-Cyclohexyl-cyclopentylmethyl)-cyclohex-2-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O
InChI InChI=1S/C18H28O/c19-17-10-4-6-14(13-17)12-16-9-5-11-18(16)15-7-2-1-3-8-15/h13,15-16,18H,1-12H2/t16-,18+/m0/s1
InChIKey YIZRQWGRIUJQAF-FUHWJXTLSA-N
Molecular Weight 260.421 g/mol
SMILES C1(=CC(=O)CCC1)C[C@]1([C@@](C2CCCCC2)(CCC1)[H])[H]
SPLASH splash10-0a4i-9200000000-446c3e26edcd190e7f5e
Source of Spectrum QE-2-1215-45
Synonyms 3-(2-Cyclohexylcyclopentylmethyl)-2-cyclohexan-1-one 3-(2-Cyclohexylcyclopentylmethyl)-2-cyclohexen-1-one 3-{[(1S,2R)-2-cyclohexylcyclopentyl]methyl}-2-cyclohexen-1-one
Wiley ID 842899