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1-S,1'-R-RODIASINE

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1-S,1'-R-RODIASINE
SpectraBase Compound ID 6ephax7vUF8
InChI InChI=1S/C38H42N2O6/c1-39-13-11-24-19-33(43-4)34-21-26(24)29(39)17-22-7-9-31(41)27(15-22)28-16-23(8-10-32(28)42-3)18-30-36-25(12-14-40(30)2)20-35(44-5)37(45-6)38(36)46-34/h7-10,15-16,19-21,29-30,41H,11-14,17-18H2,1-6H3
InChIKey HIQZXOFBXJICTD-UHFFFAOYSA-N
Mol Weight 622.8 g/mol
Molecular Formula C38H42N2O6
Exact Mass 622.304287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KiAPc0BFRxS
Name 1-S,1'-R-RODIASINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H42N2O6
InChI InChI=1S/C38H42N2O6/c1-39-13-11-24-19-33(43-4)34-21-26(24)29(39)17-22-7-9-31(41)27(15-22)28-16-23(8-10-32(28)42-3)18-30-36-25(12-14-40(30)2)20-35(44-5)37(45-6)38(36)46-34/h7-10,15-16,19-21,29-30,41H,11-14,17-18H2,1-6H3
InChIKey HIQZXOFBXJICTD-UHFFFAOYSA-N
Literature Reference Author V.ROUMY,N.FABRE,F.SOUARD,S.MASSOU,G.BOURDY,S.MAUREL,A.VALENT IN,C.MOULIS
Literature Reference Citation PLANTA.MED.,72,894(2006)
Literature Reference DOI 10.1055/s-2006-947184
Molecular Weight 622.761 g/mol
Solvent CDCl3
Source File Reference UWMZ47545