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(3a.alpha.,7.alpha.)-(+,-)-3,3a,6,7-tetrahydro-7-phenyl-1H-cyclohepta[c]furan-1-one
SpectraBase Compound ID IYXPJqLIO8W
InChI InChI=1S/C15H14O2/c16-15-14-9-12(11-5-2-1-3-6-11)7-4-8-13(14)10-17-15/h1-6,8-9,12-13H,7,10H2/t12-,13+/m0/s1
InChIKey XCMLTCYDVVXRPC-QWHCGFSZSA-N
Mol Weight 226.27 g/mol
Molecular Formula C15H14O2
Exact Mass 226.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5X0FIMLWisi
Name (3a.alpha.,7.alpha.)-(+,-)-3,3a,6,7-tetrahydro-7-phenyl-1H-cyclohepta[c]furan-1-one
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Formula C15H14O2
InChI InChI=1S/C15H14O2/c16-15-14-9-12(11-5-2-1-3-6-11)7-4-8-13(14)10-17-15/h1-6,8-9,12-13H,7,10H2/t12-,13+/m0/s1
InChIKey XCMLTCYDVVXRPC-QWHCGFSZSA-N
Molecular Weight 226.275 g/mol
SMILES C12=C[C@@](c3ccccc3)(CC=C[C@@]1(COC2=O)[H])[H]
SPLASH splash10-0gbc-3900000000-cda48f48a455a431982f
Source of Spectrum J-54-935-4
Synonyms (3aS,7S)-7-phenyl-3,3a,6,7-tetrahydro-1H-cyclohepta[c]furan-1-one
Wiley ID 1228024