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(Z)-4-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-4-hydroxybut-3-en-2-one
SpectraBase Compound ID B0SeA5zUmih
InChI InChI=1S/C18H28O2/c1-12-7-8-15-17(3,4)9-6-10-18(15,5)16(12)14(20)11-13(2)19/h7,11,15-16,20H,6,8-10H2,1-5H3/b14-11-/t15-,16+,18-/m0/s1
InChIKey IYOMABBTSBKXGO-ZFKKFQQRSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GyMrehs3Zzj
Name (Z)-4-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-4-hydroxybut-3-en-2-one
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-12-7-8-15-17(3,4)9-6-10-18(15,5)16(12)14(20)11-13(2)19/h7,11,15-16,20H,6,8-10H2,1-5H3/b14-11-/t15-,16+,18-/m0/s1
InChIKey IYOMABBTSBKXGO-ZFKKFQQRSA-N
Literature Reference Author K.B.KILLDAY,R.LONGLEY,P.J.MCCARTHY,S.A.POMPONI,A.E.WRIGHT,R. F.NEALE,M.A.SILLS
Literature Reference Citation J.NAT.PROD.,56,500(1993)
Literature Reference DOI 10.1021/np50094a008
Molecular Weight 276.419 g/mol
Solvent CDCl3
Source File Reference UWTS1215