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1-[(3S,3aR,5R,7aS)-3-hydroxy-5-isopropenyl-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-3a-yl]ethanone
SpectraBase Compound ID 7ps5t9nMzzl
InChI InChI=1S/C15H24O2/c1-10(2)12-5-7-14(4)8-6-13(17)15(14,9-12)11(3)16/h12-13,17H,1,5-9H2,2-4H3/t12-,13+,14+,15+/m1/s1
InChIKey YALFFHSIVPCNLF-QPSCCSFWSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUhiS8GLcW7
Name 1-[(3S,3aR,5R,7aS)-3-hydroxy-5-isopropenyl-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-3a-yl]ethanone
CAS Registry Number 13741-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-10(2)12-5-7-14(4)8-6-13(17)15(14,9-12)11(3)16/h12-13,17H,1,5-9H2,2-4H3/t12-,13+,14+,15+/m1/s1
InChIKey YALFFHSIVPCNLF-QPSCCSFWSA-N
Molecular Weight 236.355 g/mol
SMILES O[C@@]1([C@@]2([C@@](CC[C@](C2)(C(=C)C)[H])(CC1)C)C(=O)C)[H]
SPLASH splash10-0006-9400000000-ef961acea1a1a1447b2f
Source of Spectrum JX-2015-6-1296
Synonyms Cyperolone 1-[(3S,3aR,5R,7aS)-3-hydroxy-7a-methyl-5-(1-methylethenyl)-2,3,4,5,6,7-hexahydro-1H-inden-3a-yl]ethanone 1-[(3S,3aR,5R,7aS)-3-hydroxy-7a-methyl-5-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-inden-3a-yl]ethanone 1-[(3S,3aR,5R,7aS)-7a-methyl-3-oxidanyl-5-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-inden-3a-yl]ethanone 1-((3S,3aR,5R,7aS)-3-hydroxy-7a-methyl-5-(prop-1-en-2-yl)octahydro-1H-inden-3a-yl)ethanone
Wiley ID 1728007