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(3a.alpha.,7.alpha.)-(+,-)-3,3a,6,7-tetrahydro-5-methyl-7-phenyl-1H-cyclohepta[c]furan-1-one
SpectraBase Compound ID DsjTcBioe2o
InChI InChI=1S/C16H16O2/c1-11-7-13(12-5-3-2-4-6-12)9-15-14(8-11)10-18-16(15)17/h2-6,8-9,13-14H,7,10H2,1H3/t13-,14+/m0/s1
InChIKey VWAUITQCHGBPIY-UONOGXRCSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOM4QgR3evD
Name (3a.alpha.,7.alpha.)-(+,-)-3,3a,6,7-tetrahydro-5-methyl-7-phenyl-1H-cyclohepta[c]furan-1-one
Alternate Name(s) (3aS,7S)-5-methyl-7-phenyl-3,3a,6,7-tetrahydro-1H-cyclohepta[c]furan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-11-7-13(12-5-3-2-4-6-12)9-15-14(8-11)10-18-16(15)17/h2-6,8-9,13-14H,7,10H2,1H3/t13-,14+/m0/s1
InChIKey VWAUITQCHGBPIY-UONOGXRCSA-N
Molecular Weight 240.302 g/mol
SMILES C12=C[C@](CC(=C[C@@]2(COC1=O)[H])C)(c1ccccc1)[H]
SPLASH splash10-05ox-7900000000-50f07ecd315532e7ecb5
Source of Spectrum J-54-936-4
Wiley ID 1243488