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6(1H)-Azulenone, 2,3,3a,4,5,8a-hexahydro-4,8a-dimethyl-1-methylene-, [3aR-(3a.alpha.,4.alpha.,8a.beta.)]-
SpectraBase Compound ID Jw9UUl1YFnf
InChI InChI=1S/C13H18O/c1-9-8-11(14)6-7-13(3)10(2)4-5-12(9)13/h6-7,9,12H,2,4-5,8H2,1,3H3
InChIKey PHJCXTMGFDDQHU-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Zu8t2bcUbl
Name 6(1H)-Azulenone, 2,3,3a,4,5,8a-hexahydro-4,8a-dimethyl-1-methylene-, [3aR-(3a.alpha.,4.alpha.,8a.beta.)]-
Alternate Name(s) 2,7-Dimethyl-8-methylene-bicyclo[5.3.0]decan-5-en-4-one 4,8a-dimethyl-1-methylene-2,3,3a,4,5,8a-hexahydro-6(1H)-azulenone
CAS Registry Number 104904-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-9-8-11(14)6-7-13(3)10(2)4-5-12(9)13/h6-7,9,12H,2,4-5,8H2,1,3H3
InChIKey PHJCXTMGFDDQHU-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES C12(C=CC(=O)CC(C2CCC1=C)C)C
SPLASH splash10-052f-3900000000-a7daad4a7b0194ad85ef
Source of Spectrum I-64-1406-3
Wiley ID 1187024