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methyl (7S,8R)-6-[(E)-(2,2,2-trifluoroethylhydrazinylidene)methyl]-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylate
SpectraBase Compound ID 4D57HdQO5YS
InChI InChI=1S/C25H25F3N2O7/c1-32-19-7-14(8-20(33-2)23(19)34-3)21-16-9-18-17(36-12-37-18)6-13(16)5-15(22(21)24(31)35-4)10-29-30-11-25(26,27)28/h5-10,21-22,30H,11-12H2,1-4H3/b29-10+/t21-,22-/m1/s1
InChIKey HOAVRBAVUMWJNK-YVVPXMASSA-N
Mol Weight 522.48 g/mol
Molecular Formula C25H25F3N2O7
Exact Mass 522.161386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FekfycPBZS1
Name methyl (7S,8R)-6-[(E)-(2,2,2-trifluoroethylhydrazinylidene)methyl]-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylate
Compound Number 38
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25F3N2O7
InChI InChI=1S/C25H25F3N2O7/c1-32-19-7-14(8-20(33-2)23(19)34-3)21-16-9-18-17(36-12-37-18)6-13(16)5-15(22(21)24(31)35-4)10-29-30-11-25(26,27)28/h5-10,21-22,30H,11-12H2,1-4H3/b29-10+/t21-,22-/m1/s1
InChIKey HOAVRBAVUMWJNK-YVVPXMASSA-N
Literature Reference Author M.A.CASTRO,J.M.M.DELCORRAL,M.L.LOPEZ-VAZQUEZ,P.A.GARCIA,A.SA NFELICIANO,M.GORDALI
Literature Reference Citation MAGN.RES.CHEM.,35,808(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199711)35:11<808::aid-omr165>3.0.co;2-l
Molecular Weight 522.478 g/mol
Solvent CDCl3
Source File Reference UWCP3538