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(2'S)-5-BROMO-2-(2'-CHLORO-3'-PHENYLPROPANAMIDO)-BENZOIC-ACID
SpectraBase Compound ID 81X8L2SYUMN
InChI InChI=1S/C16H13BrClNO3/c17-11-6-7-14(12(9-11)16(21)22)19-15(20)13(18)8-10-4-2-1-3-5-10/h1-7,9,13H,8H2,(H,19,20)(H,21,22)/t13-/m0/s1
InChIKey CQIYKASAPDUXDD-ZDUSSCGKSA-N
Mol Weight 382.64 g/mol
Molecular Formula C16H13BrClNO3
Exact Mass 380.976734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DJTTM94HSxi
Name (2'S)-5-BROMO-2-(2'-CHLORO-3'-PHENYLPROPANAMIDO)-BENZOIC-ACID
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13BrClNO3
InChI InChI=1S/C16H13BrClNO3/c17-11-6-7-14(12(9-11)16(21)22)19-15(20)13(18)8-10-4-2-1-3-5-10/h1-7,9,13H,8H2,(H,19,20)(H,21,22)/t13-/m0/s1
InChIKey CQIYKASAPDUXDD-ZDUSSCGKSA-N
Literature Reference Author S.L.RUBAB,B.NISAR,A.R.RAZA,N.ULLAH,M.N.TAHIR
Literature Reference Citation MOLECULES,19,139(2014)
Literature Reference DOI 10.3390/molecules19010139
Molecular Weight 382.641 g/mol
Solvent CD3OD
Source File Reference UWBT14207