Debug Info

object
{15}
_id
:
GDInguGYHu7
spectrumID
:
GDInguGYHu7
cost
:
1
specType
:
131072
xnmrNucleus
:
0
dbLocation
:
WMS3X:532869:1
hasStructureAssignments
:
false
properties
{11}
analyticalTechnique
:
MS (GC)
analyticalTechniqueLongName
:
Mass Spectrum (GC)
isFullSpectrum
:
false
spectralOutlier
:
false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

Logged In :

Authorized Features

  • None
  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
ADVERTISEMENT
Benzenepropanoic acid, .beta.-[[(4-carboxyphenyl)sulfonyl]amino]-4-ethoxy-3-methoxy-
SpectraBase Compound ID 8N1Eqf59jZP
InChI InChI=1S/C19H21NO8S/c1-3-28-16-9-6-13(10-17(16)27-2)15(11-18(21)22)20-29(25,26)14-7-4-12(5-8-14)19(23)24/h4-10,15,20H,3,11H2,1-2H3,(H,21,22)(H,23,24)
InChIKey FNWPMSFWHSSKOE-UHFFFAOYSA-N
Mol Weight 423.44 g/mol
Molecular Formula C19H21NO8S
Exact Mass 423.098788 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 GDInguGYHu7
Name Benzenepropanoic acid, .beta.-[[(4-carboxyphenyl)sulfonyl]amino]-4-ethoxy-3-methoxy-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO8S
InChI InChI=1S/C19H21NO8S/c1-3-28-16-9-6-13(10-17(16)27-2)15(11-18(21)22)20-29(25,26)14-7-4-12(5-8-14)19(23)24/h4-10,15,20H,3,11H2,1-2H3,(H,21,22)(H,23,24)
InChIKey FNWPMSFWHSSKOE-UHFFFAOYSA-N
Molecular Weight 423.436 g/mol
SMILES OC(CC(c1cc(c(cc1)OCC)OC)NS(c1ccc(C(O)=O)cc1)(=O)=O)=O
SPLASH splash10-0itc-5922000000-52dda62a4591fefd62dc
Source of Spectrum IY-1-4470-6
Synonyms 4-[[2-carboxy-1-(4-ethoxy-3-methoxyphenyl)ethyl]sulfamoyl]benzoic acid 4-[[1-(4-ethoxy-3-methoxy-phenyl)-3-oxidanyl-3-oxidanylidene-propyl]sulfamoyl]benzoic acid
Wiley ID 1652689
ADVERTISEMENT