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1-N-[3-AMINOPHENYLETHANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE
SpectraBase Compound ID K5303Vb2J7h
InChI InChI=1S/C26H47N7O7/c27-6-1-2-7-32-8-9-38-25-17(33-19(34)11-14-4-3-5-15(29)10-14)12-16(30)24(23(25)37)40-26-20(31)22(36)21(35)18(13-28)39-26/h3-5,10,16-18,20-26,32,35-37H,1-2,6-9,11-13,27-31H2,(H,33,34)/t16-,17+,18+,20+,21+,22+,23-,24+,25-,26+/m0/s1
InChIKey MQQZQOWKEYULQI-ZHGZHUQRSA-N
Mol Weight 569.7 g/mol
Molecular Formula C26H47N7O7
Exact Mass 569.353697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4U1TytlGRNT
Name 1-N-[3-AMINOPHENYLETHANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H47N7O7
InChI InChI=1S/C26H47N7O7/c27-6-1-2-7-32-8-9-38-25-17(33-19(34)11-14-4-3-5-15(29)10-14)12-16(30)24(23(25)37)40-26-20(31)22(36)21(35)18(13-28)39-26/h3-5,10,16-18,20-26,32,35-37H,1-2,6-9,11-13,27-31H2,(H,33,34)/t16-,17+,18+,20+,21+,22+,23-,24+,25-,26+/m0/s1
InChIKey MQQZQOWKEYULQI-ZHGZHUQRSA-N
Literature Reference Author J.HADDAD,L.P.KOTRA,B.LLANO-SOTELO,C.KIM,E.F.AZUCENA,M.LIU,S. B.VAKULENKO,C.S.CHOW
Literature Reference Citation J.AM.CHEM.SOC.,124,3229(2002)
Literature Reference DOI 10.1021/ja011695m
Molecular Weight 569.702 g/mol
Sample ID 33658
Solvent D2O