Debug Info

object
{15}
_id
:
8beYe1VPNJt
spectrumID
:
8beYe1VPNJt
cost
:
1
specType
:
131072
xnmrNucleus
:
0
dbLocation
:
WMS3X:559972:1
hasStructureAssignments
:
false
properties
{10}
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
2-(2',6'-Dimethoxybiphenylcarbonyl)phenyl trifluoromethanesulfonate
SpectraBase Compound ID AE3KYfvtA2X
InChI InChI=1S/C22H17F3O6S/c1-29-18-12-7-13-19(30-2)20(18)14-8-3-4-9-15(14)21(26)16-10-5-6-11-17(16)31-32(27,28)22(23,24)25/h3-13H,1-2H3
InChIKey BEXUMSNZDYDMRS-UHFFFAOYSA-N
Mol Weight 466.43 g/mol
Molecular Formula C22H17F3O6S
Exact Mass 466.069794 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 8beYe1VPNJt
Name 2-(2',6'-Dimethoxybiphenylcarbonyl)phenyl Trifluoromethanesulfonate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17F3O6S
InChI InChI=1S/C22H17F3O6S/c1-29-18-12-7-13-19(30-2)20(18)14-8-3-4-9-15(14)21(26)16-10-5-6-11-17(16)31-32(27,28)22(23,24)25/h3-13H,1-2H3
InChIKey BEXUMSNZDYDMRS-UHFFFAOYSA-N
Molecular Weight 466.427 g/mol
SMILES C(S(Oc1c(C(c2c(-c3c(OC)cccc3OC)cccc2)=O)cccc1)(=O)=O)(F)(F)F
SPLASH splash10-014i-0011900000-9a8668a0d1118df0ec18
Source of Spectrum U1-2011-6681-14c
Wiley ID 1702958
ADVERTISEMENT