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ISOMER-A+ISOMER-B
SpectraBase Compound ID 8Iwm2p0GfPq
InChI InChI=1S/2C25H43NO3/c1-3-4-5-6-9-15-20-24(27)23(26-22-17-12-11-13-18-22)19-14-8-7-10-16-21-25(28)29-2;1-3-4-5-6-8-14-19-23(26-22-17-12-11-13-18-22)24(27)20-15-9-7-10-16-21-25(28)29-2/h2*11-13,17-18,23-24,26-27H,3-10,14-16,19-21H2,1-2H3
InChIKey BJFQJKAFJLHVOS-UHFFFAOYSA-N
Mol Weight 811.2 g/mol
Molecular Formula C50H86N2O6
Exact Mass 810.648588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LUfCH0l346E
Name ISOMER-A+ISOMER-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H86N2O6
InChI InChI=1S/2C25H43NO3/c1-3-4-5-6-9-15-20-24(27)23(26-22-17-12-11-13-18-22)19-14-8-7-10-16-21-25(28)29-2;1-3-4-5-6-8-14-19-23(26-22-17-12-11-13-18-22)24(27)20-15-9-7-10-16-21-25(28)29-2/h2*11-13,17-18,23-24,26-27H,3-10,14-16,19-21H2,1-2H3
InChIKey BJFQJKAFJLHVOS-UHFFFAOYSA-N
Literature Reference Author A.BISWAS,B.K.SHARMA,K.M.DOLL,S.Z.ERHAN,J.L.WILLETT,H.N.CHENG
Literature Reference Citation J.AGR.FOOD.CHEM.,57,8136(2009)
Literature Reference DOI 10.1021/jf901401s
Molecular Weight 811.243 g/mol
Sample ID 68135
Solvent Unknown