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3-Methyl-8a-oxidanyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]furan-2-one
SpectraBase Compound ID 2TpPOwbIPja
InChI InChI=1S/C10H14O3/c1-7-8-5-3-2-4-6-10(8,12)13-9(7)11/h12H,2-6H2,1H3
InChIKey QYOOFFBBMGGQGM-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKflh7gt8r2
Name 3-Methyl-8a-oxidanyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]furan-2-one
Alternate Name(s) 8a-hydroxy-3-methyl-4,5,6,7,8,8a-hexahydro-2H-cyclohepta[b]furan-2-one 8a-hydroxy-3-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]furan-2-one
CAS Registry Number 107115-55-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-7-8-5-3-2-4-6-10(8,12)13-9(7)11/h12H,2-6H2,1H3
InChIKey QYOOFFBBMGGQGM-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
SMILES OC12OC(=O)C(=C2CCCCC1)C
SPLASH splash10-03di-0900000000-80c9b418d5ea43f8ba0a
Source of Spectrum J-52-1436-15
Wiley ID 1178474