Debug Info

object
{15}
_id
:
3EWiOt1TPn4
spectrumID
:
3EWiOt1TPn4
cost
:
1
specType
:
8388608
xnmrNucleus
:
0
dbLocation
:
WSAHX:9824:1
hasStructureAssignments
:
false
properties
{14}
analyticalTechnique
:
1H NMR
analyticalTechniqueLongName
:
1H Nuclear Magnetic Resonance (NMR) Spectrum
isFullSpectrum
:
true
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
((p-Chlorophenyl)thio)acetic acid
SpectraBase Compound ID H64OiRZXllJ
InChI InChI=1S/C8H7ClO2S/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey YPKLXLYGMAWXDO-UHFFFAOYSA-N
Mol Weight 202.65 g/mol
Molecular Formula C8H7ClO2S
Exact Mass 201.985528 g/mol
ADVERTISEMENT

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 3EWiOt1TPn4
Name (4-Chlorophenylthio)acetic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 449091
CAS Registry Number 3405-88-7
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO2S
InChI 1S/C8H7ClO2S/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey YPKLXLYGMAWXDO-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-((4-Chlorophenyl)thio)acetic acid p-Chlorophenylmercaptoacetic acid
Wiley ID SIAL_1HNMR_009824
ADVERTISEMENT