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[N-METHYL-TETA-VINYLPHENYLALANINE-3]-RA-VII
SpectraBase Compound ID EpVFsHPLFCT
InChI InChI=1S/C42H50N6O8/c1-9-27-10-12-28(13-11-27)20-32-39(51)45-26(4)41(53)48(7)34-21-29-14-17-31(18-15-29)56-36-23-30(16-19-35(36)55-8)22-33(47(6)42(34)54)38(50)43-24(2)37(49)44-25(3)40(52)46(32)5/h9-19,23-26,32-34H,1,20-22H2,2-8H3,(H,43,50)(H,44,49)(H,45,51)/t24-,25+,26+,32+,33+,34+/m1/s1
InChIKey OBPFBFZXNJKPLS-HCQCDIKSSA-N
Mol Weight 766.9 g/mol
Molecular Formula C42H50N6O8
Exact Mass 766.369013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Wz9fvIlmkw
Name [N-METHYL-TETA-VINYLPHENYLALANINE-3]-RA-VII
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H50N6O8
InChI InChI=1S/C42H50N6O8/c1-9-27-10-12-28(13-11-27)20-32-39(51)45-26(4)41(53)48(7)34-21-29-14-17-31(18-15-29)56-36-23-30(16-19-35(36)55-8)22-33(47(6)42(34)54)38(50)43-24(2)37(49)44-25(3)40(52)46(32)5/h9-19,23-26,32-34H,1,20-22H2,2-8H3,(H,43,50)(H,44,49)(H,45,51)/t24-,25+,26+,32+,33+,34+/m1/s1
InChIKey OBPFBFZXNJKPLS-HCQCDIKSSA-N
Literature Reference Author Y.HITOTSUYANAGI,S.LEE,I.ITO,K.KONDO,K.TAKEYA,T.YAMAGISHI,T.N AGATE,H.ITOKAWA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,213(1995)
Literature Reference DOI 10.1039/p19960000213
Molecular Weight 766.894 g/mol
Solvent CDCl3
Source File Reference UWGE2312