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5H-Inden-5-one, octahydro-4-[2-(3-methoxyphenyl)ethyl]-7a-methyl-1-methylene-, [3aR-(3a.alpha.,4.alpha.,7a.beta.)]-
SpectraBase Compound ID FqjwvWt72it
InChI InChI=1S/C20H26O2/c1-14-7-10-18-17(19(21)11-12-20(14,18)2)9-8-15-5-4-6-16(13-15)22-3/h4-6,13,17-18H,1,7-12H2,2-3H3
InChIKey WPPDZBWGPOFFKS-UHFFFAOYSA-N
Mol Weight 298.43 g/mol
Molecular Formula C20H26O2
Exact Mass 298.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3viUQm1ZxJO
Name 5H-Inden-5-one, octahydro-4-[2-(3-methoxyphenyl)ethyl]-7a-methyl-1-methylene-, [3aR-(3a.alpha.,4.alpha.,7a.beta.)]-
Alternate Name(s) 1-Methoxy-17-methylene-9,10-secoestra-1(10),2,4-trien-9-one 2-(2-(3-methoxy-phenyl)-ethyl)-6-methyl-7-methylene-bicyclo[4.3.0]nonan-3-one
CAS Registry Number 98006-20-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O2
InChI InChI=1S/C20H26O2/c1-14-7-10-18-17(19(21)11-12-20(14,18)2)9-8-15-5-4-6-16(13-15)22-3/h4-6,13,17-18H,1,7-12H2,2-3H3
InChIKey WPPDZBWGPOFFKS-UHFFFAOYSA-N
Molecular Weight 298.426 g/mol
SMILES C12(C(C(CCc3cc(OC)ccc3)C(CC1)=O)CCC2=C)C
SPLASH splash10-007o-4910000000-bd81759205cb6fee993d
Source of Spectrum I-65-4-15
Wiley ID 1301520