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N(2)-[(S)-N(2)-ACETYL-2,O(4)-DIMETHYLTHYROSYL]-L-PHENYLALANINE-DIMETHYLAMIDE
SpectraBase Compound ID C4LLbZe6PSY
InChI InChI=1S/C24H31N3O4/c1-17(28)26-24(2,16-19-11-13-20(31-5)14-12-19)23(30)25-21(22(29)27(3)4)15-18-9-7-6-8-10-18/h6-14,21H,15-16H2,1-5H3,(H,25,30)(H,26,28)/t21-,24-/m0/s1
InChIKey UHMGFHWJDYAVKA-URXFXBBRSA-N
Mol Weight 425.53 g/mol
Molecular Formula C24H31N3O4
Exact Mass 425.231456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cvc8GBeq7xo
Name N(2)-[(S)-N(2)-ACETYL-2,O(4)-DIMETHYLTHYROSYL]-L-PHENYLALANINE-DIMETHYLAMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H31N3O4
InChI InChI=1S/C24H31N3O4/c1-17(28)26-24(2,16-19-11-13-20(31-5)14-12-19)23(30)25-21(22(29)27(3)4)15-18-9-7-6-8-10-18/h6-14,21H,15-16H2,1-5H3,(H,25,30)(H,26,28)/t21-,24-/m0/s1
InChIKey UHMGFHWJDYAVKA-URXFXBBRSA-N
Literature Reference Author D.OBRECHT,C.SPIEGLER,P.SCHOENHOLZER,K.MUELLER,H.HEIMGARTNER, F.STIERLI
Literature Reference Citation HELV.CHIM.ACTA,75,1666(1992)
Literature Reference DOI 10.1002/hlca.19920750522
Molecular Weight 425.528 g/mol
Solvent CDCl3
Source File Reference UWCS7752