Debug Info

object
{15}
_id
:
CptDs9h5LCL
spectrumID
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CptDs9h5LCL
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMSL3X:178868:1
hasStructureAssignments
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
isFullSpectrum
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false
spectralOutlier
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compound
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lastUpdated
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1735074081058
isDeprecated
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false

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N-(3,4-dichlorophenyl)-2-(5,6-dimethylxanthone-4-yl)-acetamide
SpectraBase Compound ID 8ISLt29p4iq
InChI InChI=1S/C23H17Cl2NO3/c1-12-6-8-17-21(28)16-5-3-4-14(23(16)29-22(17)13(12)2)10-20(27)26-15-7-9-18(24)19(25)11-15/h3-9,11H,10H2,1-2H3,(H,26,27)
InChIKey JBSBNSMMXYVTSF-UHFFFAOYSA-N
Mol Weight 426.3 g/mol
Molecular Formula C23H17Cl2NO3
Exact Mass 425.058549 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CptDs9h5LCL
Name N-(3,4-dichlorophenyl)-2-(5,6-dimethylxanthone-4-yl)-acetamide
Appearance Off-white solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17Cl2NO3
InChI InChI=1S/C23H17Cl2NO3/c1-12-6-8-17-21(28)16-5-3-4-14(23(16)29-22(17)13(12)2)10-20(27)26-15-7-9-18(24)19(25)11-15/h3-9,11H,10H2,1-2H3,(H,26,27)
InChIKey JBSBNSMMXYVTSF-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 426.299 g/mol
SMILES N(C(Cc1cccc2C(c3ccc(c(c3Oc12)C)C)=O)=O)c1cc(c(cc1)Cl)Cl
SPLASH splash10-01p9-0190000000-09d12f45a63da018a257
Source of Spectrum CN102786509A
Wiley ID 1846587
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