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N-(3,5-DINITROBENZOYL)-VALINE-METHYLESTER
SpectraBase Compound ID ENk9nOEcE4w
InChI InChI=1S/C13H15N3O7/c1-7(2)11(13(18)23-3)14-12(17)8-4-9(15(19)20)6-10(5-8)16(21)22/h4-7,11H,1-3H3,(H,14,17)
InChIKey RHAWIJIMMGELRY-UHFFFAOYSA-N
Mol Weight 325.28 g/mol
Molecular Formula C13H15N3O7
Exact Mass 325.091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AhWQwh3DBrQ
Name N-(3,5-DINITROBENZOYL)-D-VALINE-METHYLESTER;D-VAL:CBL=1:1(0.03M)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15N3O7
InChI InChI=1S/C13H15N3O7/c1-7(2)11(13(18)23-3)14-12(17)8-4-9(15(19)20)6-10(5-8)16(21)22/h4-7,11H,1-3H3,(H,14,17)
InChIKey RHAWIJIMMGELRY-UHFFFAOYSA-N
Literature Reference Author G.UCCELLO-BARRETTA,C.ROSINI,D.PINI,P.SALVADORI
Literature Reference Citation J.AM.CHEM.SOC.,112,2707(1990)
Literature Reference DOI 10.1021/ja00163a036
Molecular Weight 325.278 g/mol
Solvent CDCl3
Source File Reference UWRU6536