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3-Cubylcyclohexanone
SpectraBase Compound ID 4MMnvJhUuU1
InChI InChI=1S/C14H16O/c15-6-3-1-2-5(4-6)14-11-8-7-9(11)13(14)10(7)12(8)14/h5,7-13H,1-4H2/t5?,7-,8+,9-,10+,11+,12-,13+,14-
InChIKey SOLXMOVBRYHERP-ODPMIJQUSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lAbrJi12OT
Name 3-Cubylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c15-6-3-1-2-5(4-6)14-11-8-7-9(11)13(14)10(7)12(8)14/h5,7-13H,1-4H2/t5?,7-,8+,9-,10+,11+,12-,13+,14-
InChIKey SOLXMOVBRYHERP-ODPMIJQUSA-N
Molecular Weight 200.281 g/mol
SMILES C12([C@]3([C@]4([C@@]2([C@@]2(C4[C@]3([C@]12[H])[H])[H])[H])[H])[H])C1CC(=O)CCC1
SPLASH splash10-004l-4900000000-64f0e1dbcd0ad3fc9df3
Source of Spectrum C-116-7593-3
Synonyms 3-Pentacyclo[4.2.0.0(2,5).0(3,8).0(4,7)]oct-1-ylcyclohexanone
Wiley ID 1198397