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[3aR-(3a.alpha.,4.beta.,7a.beta.)]-octahydro-4-[(tetrahydro-2H-pyran-2-yl)oxy]-7a-methyl-1H-inden-1-one
SpectraBase Compound ID 5fYZdBxqOqs
InChI InChI=1S/C15H24O3/c1-15-9-4-5-12(11(15)7-8-13(15)16)18-14-6-2-3-10-17-14/h11-12,14H,2-10H2,1H3/t11-,12-,14?,15-/m0/s1
InChIKey VWPMWQHQXCIYGT-AHWDPPSRSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeTtnCDs15V
Name [3aR-(3a.alpha.,4.beta.,7a.beta.)]-octahydro-4-[(tetrahydro-2H-pyran-2-yl)oxy]-7a-methyl-1H-inden-1-one
Alternate Name(s) (3aR,4S,7aS)-7a-methyl-4-(tetrahydro-2H-pyran-2-yloxy)octahydro-1H-inden-1-one
CAS Registry Number 112138-94-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-15-9-4-5-12(11(15)7-8-13(15)16)18-14-6-2-3-10-17-14/h11-12,14H,2-10H2,1H3/t11-,12-,14?,15-/m0/s1
InChIKey VWPMWQHQXCIYGT-AHWDPPSRSA-N
Molecular Weight 252.354 g/mol
SMILES [C@]12([C@]([C@@](OC3OCCCC3)(CCC1)[H])(CCC2=O)[H])C
SPLASH splash10-000i-9100000000-6f2b8df57515d8619e9b
Source of Spectrum J-53-1044-17
Wiley ID 1255889