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3-(P-13-AZA-1,4,7,10-TETRAOXA-CYCLOPENTADECANE-13-YLSTYRYL)-7-(N,N-DIMETHYLAMINO)-1,4-BENZODIAZINE-2-ONE
SpectraBase Compound ID GL1A1EPqrSH
InChI InChI=1S/C28H36N4O5/c1-31(2)24-8-10-25-27(21-24)30-28(33)26(29-25)9-5-22-3-6-23(7-4-22)32-11-13-34-15-17-36-19-20-37-18-16-35-14-12-32/h3-10,21H,11-20H2,1-2H3,(H,30,33)/b9-5+
InChIKey VXCCREYIXGZAAB-WEVVVXLNSA-N
Mol Weight 508.6 g/mol
Molecular Formula C28H36N4O5
Exact Mass 508.26857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8zyNH77qblk
Name 3-(P-13-AZA-1,4,7,10-TETRAOXA-CYCLOPENTADECANE-13-YLSTYRYL)-7-(N,N-DIMETHYLAMINO)-1,4-BENZODIAZINE-2-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36N4O5
InChI InChI=1S/C28H36N4O5/c1-31(2)24-8-10-25-27(21-24)30-28(33)26(29-25)9-5-22-3-6-23(7-4-22)32-11-13-34-15-17-36-19-20-37-18-16-35-14-12-32/h3-10,21H,11-20H2,1-2H3,(H,30,33)/b9-5+
InChIKey VXCCREYIXGZAAB-WEVVVXLNSA-N
Literature Reference Author L.CAZAUX,M.FAHER,C.PICARD,P.TISNES
Literature Reference Citation CAN.J.CHEM.,71,1236(1993)
Literature Reference DOI 10.1139/v93-159
Molecular Weight 508.618 g/mol
Solvent CDCl3
Source File Reference UWVP5310