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(R,R)-6'-IODO-N-CARBOBENZYLOXY-TRYPTOPHYL-3',5'-DICHLORO-4'-METHOXY-PHENYLGLYCINE-TERT.-BUTYLESTER
SpectraBase Compound ID 4u6FjTlddas
InChI InChI=1S/C32H32Cl2IN3O6/c1-32(2,3)44-30(40)27(19-12-23(33)28(42-4)24(34)13-19)38-29(39)26(37-31(41)43-17-18-8-6-5-7-9-18)14-20-16-36-25-15-21(35)10-11-22(20)25/h5-13,15-16,26-27,36H,14,17H2,1-4H3,(H,37,41)(H,38,39)/t26-,27-/m1/s1
InChIKey NDBHQYQBKSZXLH-KAYWLYCHSA-N
Mol Weight 752.4 g/mol
Molecular Formula C32H32Cl2IN3O6
Exact Mass 751.071286 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ERtkKCfLinX
Name (R,R)-6'-IODO-N-CARBOBENZYLOXY-TRYPTOPHYL-3',5'-DICHLORO-4'-METHOXY-PHENYLGLYCINE-TERT.-BUTYLESTER
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H32Cl2IN3O6
InChI InChI=1S/C32H32Cl2IN3O6/c1-32(2,3)44-30(40)27(19-12-23(33)28(42-4)24(34)13-19)38-29(39)26(37-31(41)43-17-18-8-6-5-7-9-18)14-20-16-36-25-15-21(35)10-11-22(20)25/h5-13,15-16,26-27,36H,14,17H2,1-4H3,(H,37,41)(H,38,39)/t26-,27-/m1/s1
InChIKey NDBHQYQBKSZXLH-KAYWLYCHSA-N
Literature Reference Author Y.YAMADA,A.AKIBA,S.ARIMA,C.OKADA,K.YOSHIDA,F.ITOU,T.KAI,T.SA TOU,K.TAKEDA,Y.HARIG
Literature Reference Citation CHEM.PHARM.BULL.,53,1277(2005)
Literature Reference DOI 10.1248/cpb.53.1277
Molecular Weight 752.433 g/mol
Sample ID 33333
Solvent CDCl3