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METHYL-N-[2-NITRO-2,2-BIS-(3-PHENYLPROP-2-EN-1-YL)-ACETYL]-L-VALINATE;METHYL-N-[2-NITRO-5PHENYL-2-(3-PHENYLPROP-2-EN-1-YL)-PENT-4-ENOYL]-L-VALINATE;CPD-#8B
SpectraBase Compound ID 6aCd7uNrJPW
InChI InChI=1S/C26H30N2O5/c1-20(2)23(24(29)33-3)27-25(30)26(28(31)32,18-10-16-21-12-6-4-7-13-21)19-11-17-22-14-8-5-9-15-22/h4-17,20,23H,18-19H2,1-3H3,(H,27,30)/b16-10+,17-11+/t23-/m0/s1
InChIKey ZPKDTFHXLOGURV-QZOCIOCPSA-N
Mol Weight 450.54 g/mol
Molecular Formula C26H30N2O5
Exact Mass 450.215472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7xALNoEkkMp
Name METHYL-N-[2-NITRO-2,2-BIS-(3-PHENYLPROP-2-EN-1-YL)-ACETYL]-L-VALINATE;METHYL-N-[2-NITRO-5PHENYL-2-(3-PHENYLPROP-2-EN-1-YL)-PENT-4-ENOYL]-L-VALINATE;CPD-#8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30N2O5
InChI InChI=1S/C26H30N2O5/c1-20(2)23(24(29)33-3)27-25(30)26(28(31)32,18-10-16-21-12-6-4-7-13-21)19-11-17-22-14-8-5-9-15-22/h4-17,20,23H,18-19H2,1-3H3,(H,27,30)/b16-10+,17-11+/t23-/m0/s1
InChIKey ZPKDTFHXLOGURV-QZOCIOCPSA-N
Literature Reference Author S.G.MANJUNATHA,P.CHITTARI,S.RAJAPPA
Literature Reference Citation HELV.CHIM.ACTA,74,1071(1991)
Literature Reference DOI 10.1002/hlca.19910740516
Molecular Weight 450.535 g/mol
Solvent CDCl3
Source File Reference UWVP216