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CBZ-PHE-ALA-CH(2)-BR

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CBZ-PHE-ALA-CH(2)-BR
SpectraBase Compound ID B9JinEI2Ec2
InChI InChI=1S/C21H23BrN2O4/c1-15(19(25)13-22)23-20(26)18(12-16-8-4-2-5-9-16)24-21(27)28-14-17-10-6-3-7-11-17/h2-11,15,18H,12-14H2,1H3,(H,23,26)(H,24,27)/t15-,18-/m0/s1
InChIKey ZNYHIRBYIYJNCL-YJBOKZPZSA-N
Mol Weight 447.33 g/mol
Molecular Formula C21H23BrN2O4
Exact Mass 446.08412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Mj8WrJDovH
Name CBZ-PHE-ALA-CH(2)-BR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23BrN2O4
InChI InChI=1S/C21H23BrN2O4/c1-15(19(25)13-22)23-20(26)18(12-16-8-4-2-5-9-16)24-21(27)28-14-17-10-6-3-7-11-17/h2-11,15,18H,12-14H2,1H3,(H,23,26)(H,24,27)/t15-,18-/m0/s1
InChIKey ZNYHIRBYIYJNCL-YJBOKZPZSA-N
Literature Reference Author A.ALBECK,S.FLUSS,R.PERSKY
Literature Reference Citation J.AM.CHEM.SOC.,118,3591(1996)
Literature Reference DOI 10.1021/ja954261y
Molecular Weight 447.329 g/mol
Sample ID 37605
Solvent CDCl3