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(5aS,9aS)-5a-(4-chlorophenyl)-3,3-dimethyl-4,6,7,8,9,9a-hexahydro-2H-dibenzofuran-1-one
SpectraBase Compound ID 93iIQzvQsvM
InChI InChI=1S/C20H23ClO2/c1-19(2)11-16(22)18-15-5-3-4-10-20(15,23-17(18)12-19)13-6-8-14(21)9-7-13/h6-9,15H,3-5,10-12H2,1-2H3/t15-,20+/m0/s1
InChIKey RMWIEKAVWVPTKE-MGPUTAFESA-N
Mol Weight 330.86 g/mol
Molecular Formula C20H23ClO2
Exact Mass 330.138658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXBSl8182Se
Name (5aS,9aS)-5a-(4-chlorophenyl)-3,3-dimethyl-4,6,7,8,9,9a-hexahydro-2H-dibenzofuran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23ClO2
InChI InChI=1S/C20H23ClO2/c1-19(2)11-16(22)18-15-5-3-4-10-20(15,23-17(18)12-19)13-6-8-14(21)9-7-13/h6-9,15H,3-5,10-12H2,1-2H3/t15-,20+/m0/s1
InChIKey RMWIEKAVWVPTKE-MGPUTAFESA-N
Molecular Weight 330.855 g/mol
SMILES C12=C(O[C@@]3([C@]2(CCCC3)[H])c2ccc(cc2)Cl)CC(CC1=O)(C)C
SPLASH splash10-001i-2906000000-fea96894c722feb1491a
Source of Spectrum H1-54-178-3
Wiley ID 1564252