Debug Info

object
{15}
_id
:
3IbQc5SpE7
spectrumID
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3IbQc5SpE7
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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NCX:14757:2
hasStructureAssignments
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properties
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Spectrum
isFullSpectrum
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spectralOutlier
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compound
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1735074081058
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false

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[(2,5-dichlorophenyl)thio]acetic acid
SpectraBase Compound ID CTq0JJ7BAOS
InChI InChI=1S/C8H6Cl2O2S/c9-5-1-2-6(10)7(3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChIKey DCXXCTCEJFBLPD-UHFFFAOYSA-N
Mol Weight 237.1 g/mol
Molecular Formula C8H6Cl2O2S
Exact Mass 235.946556 g/mol
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13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3IbQc5SpE7
Name [(2,5-DICHLOROPHENYL)THIO]ACETIC ACID
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6Cl2O2S
InChI InChI=1S/C8H6Cl2O2S/c9-5-1-2-6(10)7(3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChIKey DCXXCTCEJFBLPD-UHFFFAOYSA-N
Melting Point 129C
Molecular Weight 237.11
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, //2,5-DICHLOROPHENYL/THIO/-,
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