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(5aS,9aS)-7-Methyl-3,4,5a,8,9,9a-hexahydrodibenzo[b,d]furan-1(2H)-one
SpectraBase Compound ID JgvTh6IXrDE
InChI InChI=1S/C13H16O2/c1-8-5-6-9-12(7-8)15-11-4-2-3-10(14)13(9)11/h7,9,12H,2-6H2,1H3/t9-,12+/m1/s1
InChIKey FVLIRLJNETXUIM-SKDRFNHKSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xXHh3fAOnD
Name (5aS,9aS)-7-Methyl-3,4,5a,8,9,9a-hexahydrodibenzo[b,d]furan-1(2H)-one
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.115029753 u
Formula C13H16O2
GC Column HP-5MS (15 m x 0.25 mm)
InChI InChI=1S/C13H16O2/c1-8-5-6-9-12(7-8)15-11-4-2-3-10(14)13(9)11/h7,9,12H,2-6H2,1H3/t9-,12+/m1/s1
InChIKey FVLIRLJNETXUIM-SKDRFNHKSA-N
Instrument Name Hewlett Packard Model 6890 GC-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201505027
Molecular Weight 204.269 g/mol
Quality 376
SMILES [C@@]12([C@](OC3=C2C(=O)CCC3)([H])C=C(CC1)C)[H]
SPLASH splash10-0udi-3690000000-f62891d2089d4d87a541
Source of Spectrum QE-22-SM19-9 (DOI: 10.1002/chem.201505027)
Thin-Layer Chromatography 0.32 (hexane/EtOAc, 2:1)
Wiley ID 1903670