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ERYTHRO-4-(3-BENZYLOXY-4-METHOXYPHENYL)-1-(3-HYDROXY-4-METHOXY-2,6-DIMETHYLPHENYL)-3-NITRO-2-BUTANOL
SpectraBase Compound ID 8V9sUzF9NX3
InChI InChI=1S/C27H31NO7/c1-17-12-26(34-4)27(30)18(2)21(17)15-23(29)22(28(31)32)13-20-10-11-24(33-3)25(14-20)35-16-19-8-6-5-7-9-19/h5-12,14,22-23,29-30H,13,15-16H2,1-4H3/t22-,23+/m0/s1
InChIKey AMRRZAJGTRNTHW-XZOQPEGZSA-N
Mol Weight 481.55 g/mol
Molecular Formula C27H31NO7
Exact Mass 481.210052 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPtdYkrsPxa
Name ERYTHRO-4-(3-BENZYLOXY-4-METHOXYPHENYL)-1-(3-HYDROXY-4-METHOXY-2,6-DIMETHYLPHENYL)-3-NITRO-2-BUTANOL
Compound Number E-5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H31NO7
InChI InChI=1S/C27H31NO7/c1-17-12-26(34-4)27(30)18(2)21(17)15-23(29)22(28(31)32)13-20-10-11-24(33-3)25(14-20)35-16-19-8-6-5-7-9-19/h5-12,14,22-23,29-30H,13,15-16H2,1-4H3/t22-,23+/m0/s1
InChIKey AMRRZAJGTRNTHW-XZOQPEGZSA-N
Literature Reference Author T.TAKEYA,S.MOTEGI,T.ITOH,S.TOBINAGA
Literature Reference Citation CHEM.PHARM.BULL.,45,613(1997)
Literature Reference DOI 10.1248/cpb.45.613
Molecular Weight 481.546 g/mol
Solvent CDCl3
Source File Reference UWVN28817