Debug Info

object
{15}
_id
:
GHdUcUTI43A
spectrumID
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GHdUcUTI43A
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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WRX:140735:1
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) Chemical Shifts
isFullSpectrum
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false
spectralOutlier
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false
compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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ZSCKIGAZTYXYCG-UHFFFAOYSA-N
SpectraBase Compound ID HzbvnVOymch
InChI InChI=1S/C18H14ClNO5S/c19-26(23,24)14-7-5-12(6-8-14)9-10-20-17(21)15-11-13-3-1-2-4-16(13)25-18(15)22/h1-8,11H,9-10H2,(H,20,21)
InChIKey ZSCKIGAZTYXYCG-UHFFFAOYSA-N
Mol Weight 391.83 g/mol
Molecular Formula C18H14ClNO5S
Exact Mass 391.028121 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GHdUcUTI43A
Name ZSCKIGAZTYXYCG-UHFFFAOYSA-N
Compound Number 5
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14ClNO5S
InChI InChI=1S/C18H14ClNO5S/c19-26(23,24)14-7-5-12(6-8-14)9-10-20-17(21)15-11-13-3-1-2-4-16(13)25-18(15)22/h1-8,11H,9-10H2,(H,20,21)
InChIKey ZSCKIGAZTYXYCG-UHFFFAOYSA-N
Literature Reference Author F.J.MARTINEZ-MARTINEZ,I.I.PADILLA-MARTINEZ,J.TRUJILLO-FERRAR A
Literature Reference Citation MAGN.RES.CHEM.,39,765(2001)
Literature Reference DOI 10.1002/mrc.909
Molecular Weight 391.826 g/mol
Solvent DMSO-D6
Source File Reference UWKP6372
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