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14;METHYL-(1RS,3ARS,4SR,5RS,6SR,7RS,7ASR)-4-(DIMETHOXYMETHYL)-6,7-DIMETHYL-5,6-[(1-METHYLETHYLIDENE)-DIOXY)-OCTAHYDRO-3-OXO-1-(PHENYLMETHYL)-3AH-ISOINDOLE-3A-C

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14;METHYL-(1RS,3ARS,4SR,5RS,6SR,7RS,7ASR)-4-(DIMETHOXYMETHYL)-6,7-DIMETHYL-5,6-[(1-METHYLETHYLIDENE)-DIOXY)-OCTAHYDRO-3-OXO-1-(PHENYLMETHYL)-3AH-ISOINDOLE-3A-C
SpectraBase Compound ID 6oIhQQEAyut
InChI InChI=1S/C25H35NO7/c1-14-17-16(13-15-11-9-8-10-12-15)26-21(27)25(17,22(28)31-7)18(20(29-5)30-6)19-24(14,4)33-23(2,3)32-19/h8-12,14,16-20H,13H2,1-7H3,(H,26,27)/t14-,16-,17-,18+,19-,24+,25-/m0/s1
InChIKey WTSLKFMANHVMHL-DKEQPMLBSA-N
Mol Weight 461.6 g/mol
Molecular Formula C25H35NO7
Exact Mass 461.241352 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tef1G7QVrY
Name 14;METHYL-(1RS,3ARS,4SR,5RS,6SR,7RS,7ASR)-4-(DIMETHOXYMETHYL)-6,7-DIMETHYL-5,6-[(1-METHYLETHYLIDENE)-DIOXY)-OCTAHYDRO-3-OXO-1-(PHENYLMETHYL)-3AH-ISOINDOLE-3A-C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H35NO7
InChI InChI=1S/C25H35NO7/c1-14-17-16(13-15-11-9-8-10-12-15)26-21(27)25(17,22(28)31-7)18(20(29-5)30-6)19-24(14,4)33-23(2,3)32-19/h8-12,14,16-20H,13H2,1-7H3,(H,26,27)/t14-,16-,17-,18+,19-,24+,25-/m0/s1
InChIKey WTSLKFMANHVMHL-DKEQPMLBSA-N
Literature Reference Author M.BOUTELLIER,D.WALLACH,C.TAMM
Literature Reference Citation HELV.CHIM.ACTA,76,2515(1993)
Literature Reference DOI 10.1002/hlca.19930760710
Molecular Weight 461.555 g/mol
Solvent CDCl3
Source File Reference UWVP6605