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6H,9H-Benzo[e]furo[2,3,4-cd]isobenzofuran-6-one, 2,4,4a,5,7,8,10a,10b-octahydro-5,5-dimethyl-, [4aR-(4a.alpha.,8aR*,10a.alpha.,10b.alpha.)]-
SpectraBase Compound ID 3K7JjYe7FfS
InChI InChI=1S/C15H20O3/c1-14(2)10-4-3-9-7-17-13-12(9)15(10,8-18-13)6-5-11(14)16/h3,10,12-13H,4-8H2,1-2H3/t10-,12+,13+,15+/m0/s1
InChIKey WLRHPKXUDFBEPM-XTWPYSKKSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuUeU6FTYcT
Name 6H,9H-Benzo[e]furo[2,3,4-cd]isobenzofuran-6-one, 2,4,4a,5,7,8,10a,10b-octahydro-5,5-dimethyl-, [4aR-(4a.alpha.,8aR*,10a.alpha.,10b.alpha.)]-
Alternate Name(s) (4aR,8aR,10aR,10bS)-5,5-dimethyl-2,4,4a,5,7,8,10a,10b-octahydro-6H-benzo[e]furo[2,3,4-cd][2]benzofuran-6-one Marasmen-3-one
CAS Registry Number 124894-87-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-14(2)10-4-3-9-7-17-13-12(9)15(10,8-18-13)6-5-11(14)16/h3,10,12-13H,4-8H2,1-2H3/t10-,12+,13+,15+/m0/s1
InChIKey WLRHPKXUDFBEPM-XTWPYSKKSA-N
Molecular Weight 248.322 g/mol
SMILES [C@@]123[C@](C(C)(C)C(CC3)=O)(CC=C3[C@@]1([C@@](OC3)([H])OC2)[H])[H]
SPLASH splash10-0apj-5910000000-a986187c5a5347067bcd
Source of Spectrum I-67-1376-18
Wiley ID 1251399