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3a,6,6-Trimethyl-hexahydro-benzofuran-2-one
SpectraBase Compound ID 6fTebBPtkBW
InChI InChI=1S/C11H18O2/c1-10(2)4-5-11(3)7-9(12)13-8(11)6-10/h8H,4-7H2,1-3H3
InChIKey WIVRTEBSHFWEMQ-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRgna2JZl5c
Name 3a,6,6-Trimethyl-hexahydro-benzofuran-2-one
Alternate Name(s) 3a,6,6-trimethyl-4,5,7,7a-tetrahydro-3H-1-benzofuran-2-one 3a,6,6-trimethyl-4,5,7,7a-tetrahydro-3H-benzofuran-2-one 3a,6,6-Trimethylhexahydro-1-benzofuran-2(3H)-one
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Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-10(2)4-5-11(3)7-9(12)13-8(11)6-10/h8H,4-7H2,1-3H3
InChIKey WIVRTEBSHFWEMQ-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES C12(C(OC(C2)=O)CC(CC1)(C)C)C
SPLASH splash10-096r-9600000000-c83a89b48b485affec1c
Source of Spectrum CM-1999-20552-0
Wiley ID 482906