Debug Info

object
{15}
_id
:
7F4yF0SFwb
spectrumID
:
7F4yF0SFwb
cost
:
1
specType
:
131072
xnmrNucleus
:
0
dbLocation
:
WMS3X:606254:1
hasStructureAssignments
:
false
properties
{15}
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
Phenyl 4-(methylthio)benzoate
SpectraBase Compound ID JjykEB9r99y
InChI InChI=1S/C14H12O2S/c1-17-13-9-7-11(8-10-13)14(15)16-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey MTAVXTWNVKGDPI-UHFFFAOYSA-N
Mol Weight 244.31 g/mol
Molecular Formula C14H12O2S
Exact Mass 244.055801 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 7F4yF0SFwb
Name Phenyl 4-(methylthio)benzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.055800798 u
Formula C14H12O2S
InChI InChI=1S/C14H12O2S/c1-17-13-9-7-11(8-10-13)14(15)16-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey MTAVXTWNVKGDPI-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612624
Molecular Weight 244.308 g/mol
Quality 59
SMILES C1(=CC=CC=C1)OC(C1=CC=C(C=C1)SC)=O
SPLASH splash10-0udi-3900000000-86a34ef9d1f9f8495398
Source of Spectrum ACI-56-SM3-1o (DOI: 10.1002/anie.201612624)
Wiley ID 1895573
ADVERTISEMENT