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(S)-METHYL_3-(3-BROMO-4-METHOXYPHENYL)-2-((N-TERT.-BUTYLCARBONYL)-(METHYL)-AMINO)-PROPANOATE
SpectraBase Compound ID BRJVVRGe2vL
InChI InChI=1S/C17H24BrNO5/c1-17(2,3)24-16(21)19(4)13(15(20)23-6)10-11-7-8-14(22-5)12(18)9-11/h7-9,13H,10H2,1-6H3/t13-/m0/s1
InChIKey WTJDJMQKZMXKRJ-ZDUSSCGKSA-N
Mol Weight 402.29 g/mol
Molecular Formula C17H24BrNO5
Exact Mass 401.083786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID yi99tr0q3Q
Name (S)-METHYL_3-(3-BROMO-4-METHOXYPHENYL)-2-((N-TERT.-BUTYLCARBONYL)-(METHYL)-AMINO)-PROPANOATE
Compound Number 12A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H24BrNO5
InChI InChI=1S/C17H24BrNO5/c1-17(2,3)24-16(21)19(4)13(15(20)23-6)10-11-7-8-14(22-5)12(18)9-11/h7-9,13H,10H2,1-6H3/t13-/m0/s1
InChIKey WTJDJMQKZMXKRJ-ZDUSSCGKSA-N
Literature Reference Author S.K.KOTTAKOTA,D.EVANGELOPOULOS,A.ALNIMR,S.BHAKTA,T.D.MCHUGH, M.GRAY,P.W.GROUNDWAT
Literature Reference Citation J.NAT.PROD.,75,1090(2012)
Literature Reference DOI 10.1021/np300102z
Molecular Weight 402.285 g/mol
Sample ID 41114
Solvent CDCl3