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(Z,2RS,3RS)-9-(TERT.-BUTOXYCARBONYL)-2,3-DIHYDRO-8-[2-(METHOXYCARBONYL)-ETHYL]-2,7-DIMETHYL-3-[2-(2-NITROPHENYLSELENO)-ETHYL]-DIPYRRIN-1(10H)-ONE
SpectraBase Compound ID 1QXNWqUWXBl
InChI InChI=1S/C28H35N3O7Se/c1-16-19(11-12-24(32)37-6)25(27(34)38-28(3,4)5)29-20(16)15-21-18(17(2)26(33)30-21)13-14-39-23-10-8-7-9-22(23)31(35)36/h7-10,15,17-18,29H,11-14H2,1-6H3,(H,30,33)/b21-15-/t17-,18-/m1/s1
InChIKey SDYBVWMCBYECRT-HCKWXXCWSA-N
Mol Weight 604.6 g/mol
Molecular Formula C28H35N3O7Se
Exact Mass 605.164022 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQoLXeJbRG4
Name (Z,2RS,3RS)-9-(TERT.-BUTOXYCARBONYL)-2,3-DIHYDRO-8-[2-(METHOXYCARBONYL)-ETHYL]-2,7-DIMETHYL-3-[2-(2-NITROPHENYLSELENO)-ETHYL]-DIPYRRIN-1(10H)-ONE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H35N3O7Se
InChI InChI=1S/C28H35N3O7Se/c1-16-19(11-12-24(32)37-6)25(27(34)38-28(3,4)5)29-20(16)15-21-18(17(2)26(33)30-21)13-14-39-23-10-8-7-9-22(23)31(35)36/h7-10,15,17-18,29H,11-14H2,1-6H3,(H,30,33)/b21-15-/t17-,18-/m1/s1
InChIKey SDYBVWMCBYECRT-HCKWXXCWSA-N
Literature Reference Author A.GOSSAUER,F.NYDEGGER,E.BENEDIKT,H.P.KOEST
Literature Reference Citation HELV.CHIM.ACTA,72,518(1989)
Literature Reference DOI 10.1002/hlca.19890720315
Molecular Weight 604.562 g/mol
Solvent CDCl3
Source File Reference UWCS10652