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BOC-DAP(Z)-DAP(Z)-CH2CL

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BOC-DAP(Z)-DAP(Z)-CH2CL
SpectraBase Compound ID thyXotWAfB
InChI InChI=1S/C28H35ClN4O8/c1-28(2,3)41-27(38)33-22(16-31-26(37)40-18-20-12-8-5-9-13-20)24(35)32-21(23(34)14-29)15-30-25(36)39-17-19-10-6-4-7-11-19/h4-13,21-22H,14-18H2,1-3H3,(H,30,36)(H,31,37)(H,32,35)(H,33,38)/t21-,22-/m0/s1
InChIKey RDJBTAUAXZSVQP-VXKWHMMOSA-N
Mol Weight 591.1 g/mol
Molecular Formula C28H35ClN4O8
Exact Mass 590.214342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrI75njF0V6
Name BOC-DAP(Z)-DAP(Z)-CH2CL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H35ClN4O8
InChI InChI=1S/C28H35ClN4O8/c1-28(2,3)41-27(38)33-22(16-31-26(37)40-18-20-12-8-5-9-13-20)24(35)32-21(23(34)14-29)15-30-25(36)39-17-19-10-6-4-7-11-19/h4-13,21-22H,14-18H2,1-3H3,(H,30,36)(H,31,37)(H,32,35)(H,33,38)/t21-,22-/m0/s1
InChIKey RDJBTAUAXZSVQP-VXKWHMMOSA-N
Literature Reference Author A.MIYAZAKI,Y.FUJISAWA,K.SHIOTANI,Y.FUJITA,T.LI,Y.TSUDA,T.YOK OI,S.D.BRYANT,L.H.LA
Literature Reference Citation CHEM.PHARM.BULL.,53,1152(2005)
Literature Reference DOI 10.1248/cpb.53.1152
Molecular Weight 591.061 g/mol
Sample ID 54117
Solvent DMSO-D6:A_DROP_OF_TFA