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1,2,3,4,6A,7,8,9A-OCTAHYDRO-7,8-DIMETHYL-1,4-DIOXO-6-(TRIPHENYLPHOSPHORANYLIDENAMINO)-FURO-[2,3-F]-PHTHALAZINE-6A-CARBOXYLIC-ACID,ETHYLESTER
SpectraBase Compound ID 5IDRxp0uex9
InChI InChI=1S/C33H32N3O5P/c1-4-40-32(39)33-21(2)22(3)41-29(33)28-26(30(37)34-35-31(28)38)20-27(33)36-42(23-14-8-5-9-15-23,24-16-10-6-11-17-24)25-18-12-7-13-19-25/h5-22,29H,4H2,1-3H3,(H,34,37)(H,35,38)
InChIKey OOQQKVKYWYYUHO-UHFFFAOYSA-N
Mol Weight 581.6 g/mol
Molecular Formula C33H32N3O5P
Exact Mass 581.207958 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyVAfAVWGD2
Name 1,2,3,4,6A,7,8,9A-OCTAHYDRO-7,8-DIMETHYL-1,4-DIOXO-6-(TRIPHENYLPHOSPHORANYLIDENAMINO)-FURO-[2,3-F]-PHTHALAZINE-6A-CARBOXYLIC-ACID,ETHYLESTER
CAS Registry Number 115483-92-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H32N3O5P
InChI InChI=1S/C33H32N3O5P/c1-4-40-32(39)33-21(2)22(3)41-29(33)28-26(30(37)34-35-31(28)38)20-27(33)36-42(23-14-8-5-9-15-23,24-16-10-6-11-17-24)25-18-12-7-13-19-25/h5-22,29H,4H2,1-3H3,(H,34,37)(H,35,38)
InChIKey OOQQKVKYWYYUHO-UHFFFAOYSA-N
Literature Reference Author H.WAMHOFF,F.J.FASSBENDER,M.NIEGER
Literature Reference Citation CHEM.BER.,121,2157(1988)
Literature Reference DOI 10.1002/cber.19881211214
Molecular Weight 581.608 g/mol
Solvent CDCl3
Source File Reference UWGB1713