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(3S,9R,9aS)-5,5,9-trimethyl-2,3,5,6,7,8,9,9a-octahydro-1H-benzo[7]-annulene-3-carbaldehyde
SpectraBase Compound ID 2gMiuCuvkho
InChI InChI=1S/C15H24O/c1-11-5-4-8-15(2,3)14-9-12(10-16)6-7-13(11)14/h9-13H,4-8H2,1-3H3/t11-,12+,13+/m1/s1
InChIKey JGHPPNJNIGZKDH-AGIUHOORSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HlM9QBmKGap
Name (3-S,9-R,9A-S)-5,5,9-TRIMETHYL-2,3,5,6,7,8,9,9A-OCTAHYDRO-1-H-BENZO-[7]-ANNULENE-3-CARBALDEHYDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-11-5-4-8-15(2,3)14-9-12(10-16)6-7-13(11)14/h9-13H,4-8H2,1-3H3/t11-,12+,13+/m1/s1
InChIKey JGHPPNJNIGZKDH-AGIUHOORSA-N
Literature Reference Author R.J.BARTELT,B.W.ZILKOWSKI,A.A.COSSE,U.SCHNUPF,K.VERMILLION,F .A.MOMANY
Literature Reference Citation J.NAT.PROD.,74,585(2011)
Literature Reference DOI 10.1021/np100608p
Molecular Weight 220.355 g/mol
Sample ID 37373
Solvent C6D6