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(3ARS,4SR,7RS,7ASR)-3,3-DIALLYL-2-BENZYL-2,3,3A,4,7,7A-HEXAHYDRO-1H-4,7-METHANOISOINDOL-1-ONE
SpectraBase Compound ID LXNGtftswpY
InChI InChI=1S/C22H25NO/c1-3-12-22(13-4-2)20-18-11-10-17(14-18)19(20)21(24)23(22)15-16-8-6-5-7-9-16/h3-11,17-20H,1-2,12-15H2/t17-,18+,19-,20+/m0/s1
InChIKey HLYKJDDZDCJDOR-ZGXWSNOMSA-N
Mol Weight 319.45 g/mol
Molecular Formula C22H25NO
Exact Mass 319.193614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ws37Fx0dfw
Name (3ARS,4SR,7RS,7ASR)-3,3-DIALLYL-2-BENZYL-2,3,3A,4,7,7A-HEXAHYDRO-1H-4,7-METHANOISOINDOL-1-ONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25NO
InChI InChI=1S/C22H25NO/c1-3-12-22(13-4-2)20-18-11-10-17(14-18)19(20)21(24)23(22)15-16-8-6-5-7-9-16/h3-11,17-20H,1-2,12-15H2/t17-,18+,19-,20+/m0/s1
InChIKey HLYKJDDZDCJDOR-ZGXWSNOMSA-N
Literature Reference Author A.GOMEZ-SANJUAN,N.SOTOMAYOR,E.LETE
Literature Reference Citation EUR.J.ORG.CHEM.,2013,6722(2013)
Literature Reference DOI 10.1002/ejoc.201300889
Molecular Weight 319.447 g/mol
Solvent CDCl3
Source File Reference UWBT18489