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5-METHYL-2-OXO-9C-PHENYL-3-PROPYL-2,3,4,4A,5,9C-HEXAHYDRO-3-AZA-PENTALENO-[1,6-AB]-NAPHTHALENE-1,2A-DICARBOXYLIC-ACID-DIMETHYLESTER

View entire compound with spectra: 1 NMR

5-METHYL-2-OXO-9C-PHENYL-3-PROPYL-2,3,4,4A,5,9C-HEXAHYDRO-3-AZA-PENTALENO-[1,6-AB]-NAPHTHALENE-1,2A-DICARBOXYLIC-ACID-DIMETHYLESTER
SpectraBase Compound ID FNEHNujF13j
InChI InChI=1S/C28H29NO5/c1-5-15-29-16-21-17(2)19-13-9-10-14-20(19)23-22(25(31)33-3)24(30)28(29,26(32)34-4)27(21,23)18-11-7-6-8-12-18/h6-14,17,21H,5,15-16H2,1-4H3/t17?,21-,27-,28-/m1/s1
InChIKey NQKYDDQGLNBHKX-KRHAAWDBSA-N
Mol Weight 459.54 g/mol
Molecular Formula C28H29NO5
Exact Mass 459.204573 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ScmW6yzDhU
Name 5-METHYL-2-OXO-9C-PHENYL-3-PROPYL-2,3,4,4A,5,9C-HEXAHYDRO-3-AZA-PENTALENO-[1,6-AB]-NAPHTHALENE-1,2A-DICARBOXYLIC-ACID-DIMETHYLESTER
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H29NO5
InChI InChI=1S/C28H29NO5/c1-5-15-29-16-21-17(2)19-13-9-10-14-20(19)23-22(25(31)33-3)24(30)28(29,26(32)34-4)27(21,23)18-11-7-6-8-12-18/h6-14,17,21H,5,15-16H2,1-4H3/t17?,21-,27-,28-/m1/s1
InChIKey NQKYDDQGLNBHKX-KRHAAWDBSA-N
Literature Reference Author Y.YOSHITAKE,K.YAMAGUCHI,C.KAI,T.AKIYAMA,C.HANDA,T.JIKYO,K.HA RANO
Literature Reference Citation J.ORG.CHEM.,66,8902(2001)
Literature Reference DOI 10.1021/jo015941o
Molecular Weight 459.542 g/mol
Solvent CDCl3
Source File Reference UWVN26576