Debug Info

object
{0}
(empty object)

Logged In :

Authorized Features

  • None
  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
ADVERTISEMENT
(1S,3S)-2-Benzyl 3-Methyl 1-(2-methoxycarbonylethyl)-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole-2,3-dicarboxylate
SpectraBase Compound ID 4DnnOSq7WgY
InChI InChI=1S/C25H26N2O6/c1-31-22(28)13-12-20-23-18(17-10-6-7-11-19(17)26-23)14-21(24(29)32-2)27(20)25(30)33-15-16-8-4-3-5-9-16/h3-11,20-21,26H,12-15H2,1-2H3/t20-,21-/m0/s1
InChIKey UIGJIABZUAZEBC-SFTDATJTSA-N
Mol Weight 450.49 g/mol
Molecular Formula C25H26N2O6
Exact Mass 450.179087 g/mol
ADVERTISEMENT

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CJ9RmvPtf5z
Name (1S,3S)-2-Benzyl 3-Methyl 1-(2-methoxycarbonylethyl)-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole-2,3-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N2O6
InChI InChI=1S/C25H26N2O6/c1-31-22(28)13-12-20-23-18(17-10-6-7-11-19(17)26-23)14-21(24(29)32-2)27(20)25(30)33-15-16-8-4-3-5-9-16/h3-11,20-21,26H,12-15H2,1-2H3/t20-,21-/m0/s1
InChIKey UIGJIABZUAZEBC-SFTDATJTSA-N
Molecular Weight 450.491 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](N([C@@](C2)(C(=O)OC)[H])C(OCc1ccccc1)=O)(CCC(=O)OC)[H]
SPLASH splash10-00kf-9104200000-727b46cd155b0f44c4bc
Source of Spectrum KC-1993-445-19
Synonyms 2-Benzyl 3-methyl (1S,3S)-1-(3-methoxy-3-oxopropyl)-1,3,4,9-tetrahydro-2H-.beta.-carboline-2,3-dicarboxylate
Wiley ID 779151
ADVERTISEMENT