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(-)-3-Butyl-4-methylbicylo[4.3.0]non-1(9)-en-2-one

View entire compound with spectra: 3 MS (GC)

(-)-3-Butyl-4-methylbicylo[4.3.0]non-1(9)-en-2-one
SpectraBase Compound ID AnX2yUngII
InChI InChI=1S/C14H22O/c1-3-4-7-12-10(2)9-11-6-5-8-13(11)14(12)15/h8,10-12H,3-7,9H2,1-2H3/t10-,11-,12+/m0/s1
InChIKey MDIAFJQMDFHRLH-SDDRHHMPSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9b56PIDwyvq
Name (-)-3-Butyl-4-methylbicylo[4.3.0]non-1(9)-en-2-one
Alternate Name(s) exo-3-butyl-exo-4-methylbicyclo[4.3.0]non-1(9)-en-2-one (5R,6S,7aS)-5-butyl-6-methyl-1,2,5,6,7,7a-hexahydroinden-4-one 4H-Inden-4-one, 5-butyl-1,2,5,6,7,7a-hexahydro-6-methyl-, (5.alpha.,6.beta.,7a.beta.)-(.+-.)- endo-3-butyl-exo-4-methylbicyclo[4.3.0]non-1(9)-en-2-one
CAS Registry Number 88525-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-3-4-7-12-10(2)9-11-6-5-8-13(11)14(12)15/h8,10-12H,3-7,9H2,1-2H3/t10-,11-,12+/m0/s1
InChIKey MDIAFJQMDFHRLH-SDDRHHMPSA-N
Molecular Weight 206.329 g/mol
SMILES C1(C=2[C@](CCC2)([H])C[C@@]([C@]1(CCCC)[H])(C)[H])=O
SPLASH splash10-0udi-0900000000-8eeb804b7273a5b10996
Source of Spectrum J-53-3673-8
Wiley ID 1205215