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(3aS,4R,7aR)-7a-Hydroxy-3a,4-dimethyl-hexahydro-benzofuran-2-one
SpectraBase Compound ID 33NwT1B7fzg
InChI InChI=1S/C10H16O3/c1-7-4-3-5-10(12)9(7,2)6-8(11)13-10/h7,12H,3-6H2,1-2H3/t7-,9+,10-/m1/s1
InChIKey QZHGTRNLDHWFRM-FKTZTGRPSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQVVIcZpNoX
Name (3aS,4R,7aR)-7a-Hydroxy-3a,4-dimethyl-hexahydro-benzofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-7-4-3-5-10(12)9(7,2)6-8(11)13-10/h7,12H,3-6H2,1-2H3/t7-,9+,10-/m1/s1
InChIKey QZHGTRNLDHWFRM-FKTZTGRPSA-N
Molecular Weight 184.235 g/mol
SMILES O[C@]12[C@@](CC(O2)=O)([C@](C)(CCC1)[H])C
SPLASH splash10-002b-9500000000-99e840ab86a495726f44
Source of Spectrum QE-15-914-15
Synonyms 7a-Hydroxy-3a,4-dimethyl-hexahydrobenzofuran-2(3H)-one (3aS,4R,7aR)-7a-hydroxy-3a,4-dimethyl-4,5,6,7-tetrahydro-3H-1-benzofuran-2-one (3aS,4R,7aR)-3a,4-dimethyl-7a-oxidanyl-4,5,6,7-tetrahydro-3H-1-benzofuran-2-one
Wiley ID 1692658