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N(ALPHA)-(BENZYLOXYCARBONYL-L-ALANYL)-N-(3,3,3-TRIFLUORO-2-OXOPROPYL)-L-METHIONAMIDE
SpectraBase Compound ID CfPKsSgdSJU
InChI InChI=1S/C19H24F3N3O5S/c1-12(24-18(29)30-11-13-6-4-3-5-7-13)16(27)25-14(8-9-31-2)17(28)23-10-15(26)19(20,21)22/h3-7,12,14H,8-11H2,1-2H3,(H,23,28)(H,24,29)(H,25,27)/t12-,14-/m0/s1
InChIKey STYBDUDWKVDGNK-JSGCOSHPSA-N
Mol Weight 463.47 g/mol
Molecular Formula C19H24F3N3O5S
Exact Mass 463.138877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95auSbZYQ7w
Name N(ALPHA)-(BENZYLOXYCARBONYL-L-ALANYL)-N-(3,3,3-TRIFLUORO-2-OXOPROPYL)-L-METHIONAMIDE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H24F3N3O5S
InChI InChI=1S/C19H24F3N3O5S/c1-12(24-18(29)30-11-13-6-4-3-5-7-13)16(27)25-14(8-9-31-2)17(28)23-10-15(26)19(20,21)22/h3-7,12,14H,8-11H2,1-2H3,(H,23,28)(H,24,29)(H,25,27)/t12-,14-/m0/s1
InChIKey STYBDUDWKVDGNK-JSGCOSHPSA-N
Literature Reference Author C.W.DERSTINE,D.N.SMITH,J.A.KATZENELLENBOGEN
Literature Reference Citation J.AM.CHEM.SOC.,118,8485(1996)
Literature Reference DOI 10.1021/ja9614833
Molecular Weight 463.472 g/mol
Sample ID 36273
Solvent DMSO-D6:D2O