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11,12,13-TRI-NOR-CIS-EUDESM-5-EN-7-ONE;(4AS,8R)-DIMETHYL-4,4A,5,6,7,8-HEXAHYDRO-NAPHTHALEN-2(3H)-ONE;REFERENCE
SpectraBase Compound ID CYEsPCoNp6a
InChI InChI=1S/C12H18O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h8-9H,3-7H2,1-2H3/t9-,12+/m1/s1
InChIKey KLTKQWRPJDRMTL-SKDRFNHKSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BkXH7UpnKMR
Name 11,12,13-TRI-NOR-CIS-EUDESM-5-EN-7-ONE;(4AS,8R)-DIMETHYL-4,4A,5,6,7,8-HEXAHYDRO-NAPHTHALEN-2(3H)-ONE;REFERENCE
Compound Number 61A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h8-9H,3-7H2,1-2H3/t9-,12+/m1/s1
InChIKey KLTKQWRPJDRMTL-SKDRFNHKSA-N
Literature Reference Author P.WEYERSTAHL,H.MARSCHALL,U.SPLITTGERBER,D.WOLF
Literature Reference Citation FLAV.FRAGR.,15,61(2000)
Molecular Weight 178.274 g/mol
Solvent CDCl3
Source File Reference UWLU80797