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(cis)-Hexahydro-7a-methylbenzofuran-2(3H)-one
SpectraBase Compound ID KJcvudxikYC
InChI InChI=1S/C9H14O2/c1-9-5-3-2-4-7(9)6-8(10)11-9/h7H,2-6H2,1H3/t7-,9-/m0/s1
InChIKey YGHCAHWARGVWQD-CBAPKCEASA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dDlMTxy4z8
Name (cis)-Hexahydro-7a-methylbenzofuran-2(3H)-one
Alternate Name(s) (3aS,7aS)-7a-methylhexahydro-1-benzofuran-2(3H)-one (3aS,7aS)-7a-methyl-3,3a,4,5,6,7-hexahydro-1-benzofuran-2-one
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Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-9-5-3-2-4-7(9)6-8(10)11-9/h7H,2-6H2,1H3/t7-,9-/m0/s1
InChIKey YGHCAHWARGVWQD-CBAPKCEASA-N
Molecular Weight 154.209 g/mol
SMILES [C@@]12(OC(C[C@@]2(CCCC1)[H])=O)C
SPLASH splash10-03dr-4900000000-81202bb79e82700b9391
Source of Spectrum H-77-652-6
Wiley ID 1151398