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REL-LABD-12-EN-15(16)-OLID-7-ONE-8R-SPIRO-1'-[2S-(2,4,5-TRIMETHOXYPHENYL)-3-CYCLOHEXENE]
SpectraBase Compound ID 7vH2pKWpRzE
InChI InChI=1S/C33H44O6/c1-31(2)14-9-15-32(3)27(12-11-21-13-17-39-30(21)35)33(29(34)20-28(31)32)16-8-7-10-23(33)22-18-25(37-5)26(38-6)19-24(22)36-4/h7,10-11,18-19,23,27-28H,8-9,12-17,20H2,1-6H3/b21-11+/t23-,27+,28-,32+,33-/m0/s1
InChIKey PBWIOCBYNCZUKR-KFRZDANKSA-N
Mol Weight 536.7 g/mol
Molecular Formula C33H44O6
Exact Mass 536.313789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hw1iRXuisTK
Name REL-LABD-12-EN-15(16)-OLID-7-ONE-8R-SPIRO-1'-[2S-(2,4,5-TRIMETHOXYPHENYL)-3-CYCLOHEXENE]
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H44O6
InChI InChI=1S/C33H44O6/c1-31(2)14-9-15-32(3)27(12-11-21-13-17-39-30(21)35)33(29(34)20-28(31)32)16-8-7-10-23(33)22-18-25(37-5)26(38-6)19-24(22)36-4/h7,10-11,18-19,23,27-28H,8-9,12-17,20H2,1-6H3/b21-11+/t23-,27+,28-,32+,33-/m0/s1
InChIKey PBWIOCBYNCZUKR-KFRZDANKSA-N
Literature Reference Author S.TESAKI,H.KIKUZAKI,S.YONEMORI,N.NAKATANI
Literature Reference Citation J.NAT.PROD.,64,515(2001)
Literature Reference DOI 10.1021/np0004855
Molecular Weight 536.709 g/mol
Solvent CDCl3
Source File Reference UWRU9377