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(RAC)-DIETHYL-3-BENZOYL-1,2,3,10B-TETRAHYDRO-PYRROLO-[2,1-A]-ISOQUINOLINE-1,2-DICARBOXYLATE;MAJOR-DIASTEREOISOMER
SpectraBase Compound ID F7RKnvbd2G5
InChI InChI=1S/C25H25NO5/c1-3-30-24(28)19-20(25(29)31-4-2)22(23(27)17-11-6-5-7-12-17)26-15-14-16-10-8-9-13-18(16)21(19)26/h5-15,19-22H,3-4H2,1-2H3/t19-,20-,21-,22+/m0/s1
InChIKey LIFBUKMBDQRZJE-MYGLTJDJSA-N
Mol Weight 419.48 g/mol
Molecular Formula C25H25NO5
Exact Mass 419.173273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2F9UBRoMYXh
Name (RAC)-DIETHYL-3-BENZOYL-1,2,3,10B-TETRAHYDRO-PYRROLO-[2,1-A]-ISOQUINOLINE-1,2-DICARBOXYLATE;MAJOR-DIASTEREOISOMER
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25NO5
InChI InChI=1S/C25H25NO5/c1-3-30-24(28)19-20(25(29)31-4-2)22(23(27)17-11-6-5-7-12-17)26-15-14-16-10-8-9-13-18(16)21(19)26/h5-15,19-22H,3-4H2,1-2H3/t19-,20-,21-,22+/m0/s1
InChIKey LIFBUKMBDQRZJE-MYGLTJDJSA-N
Literature Reference Author D.S.ALLGAEUER,H.MAYR
Literature Reference Citation EUR.J.ORG.CHEM.,2014,2956(2014)
Literature Reference DOI 10.1002/ejoc.201301779
Molecular Weight 419.477 g/mol
Solvent CDCl3
Source File Reference UWIR19853