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(3aR,5aR,8R,9aS)-8-(Benzoyloxy)-3,3a,5a,8,9,9a-hexahydro-3a,5a,6-trimethyl-2H-benz[e]inden-2-one
SpectraBase Compound ID CQjYil22Rx9
InChI InChI=1S/C23H24O3/c1-15-11-18(26-21(25)16-7-5-4-6-8-16)13-20-19-12-17(24)14-22(19,2)9-10-23(15,20)3/h4-12,18,20H,13-14H2,1-3H3/t18-,20-,22-,23-/m0/s1
InChIKey TWYUFUHHGKELPO-HMNCIZAVSA-N
Mol Weight 348.44 g/mol
Molecular Formula C23H24O3
Exact Mass 348.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOhRXIo3EUr
Name (3aR,5aR,8R,9aS)-8-(Benzoyloxy)-3,3a,5a,8,9,9a-hexahydro-3a,5a,6-trimethyl-2H-benz[e]inden-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24O3
InChI InChI=1S/C23H24O3/c1-15-11-18(26-21(25)16-7-5-4-6-8-16)13-20-19-12-17(24)14-22(19,2)9-10-23(15,20)3/h4-12,18,20H,13-14H2,1-3H3/t18-,20-,22-,23-/m0/s1
InChIKey TWYUFUHHGKELPO-HMNCIZAVSA-N
Molecular Weight 348.442 g/mol
SMILES C=12[C@]3([C@@](C(C)=C[C@@](C3)(OC(=O)c3ccccc3)[H])(C)C=C[C@]2(CC(C1)=O)C)[H]
SPLASH splash10-053r-7951000000-bfe127b709436eaffd6c
Source of Spectrum I-82-261-16
Synonyms (3aR,5aR,8R,9aS)-3a,5a,6-trimethyl-2-oxo-3,3a,5a,8,9,9a-hexahydro-2H-cyclopenta[a]naphthalen-8-yl benzoate 8-(Benzoyloxy)-3,3a,5a,8,9,9a-hexahydro-5-methanesulfonyloxy-3a,5a,6-trimethyl-2H-benz[e]inden-2-one
Wiley ID 1551609