Debug Info

object
{15}
_id
:
IcF31LCAwBM
spectrumID
:
IcF31LCAwBM
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMS3X:370375:1
hasStructureAssignments
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false
properties
{10}
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
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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2-[(p-chlorobenzyl)thio]-5,7-dimethyl-s-triazolo[1,5-a]pyrimidine
SpectraBase Compound ID DXS8Eyaov7z
InChI InChI=1S/C14H13ClN4S/c1-9-7-10(2)19-13(16-9)17-14(18-19)20-8-11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3
InChIKey HJOJVYPLOUSZAX-UHFFFAOYSA-N
Mol Weight 304.8 g/mol
Molecular Formula C14H13ClN4S
Exact Mass 304.054945 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IcF31LCAwBM
Name 2-[(4-chlorobenzyl)sulfanyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13ClN4S
InChI InChI=1S/C14H13ClN4S/c1-9-7-10(2)19-13(16-9)17-14(18-19)20-8-11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3
InChIKey HJOJVYPLOUSZAX-UHFFFAOYSA-N
Molecular Weight 304.799 g/mol
SMILES c12[n](nc(n2)SCc2ccc(Cl)cc2)C(C)=CC(=N1)C
SPLASH splash10-0fbi-8923000000-c1a21218948baf069598
Synonyms 2-[(4-chlorobenzyl)thio]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine 2-[(4-chlorophenyl)methylsulfanyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine 2-[(4-chlorophenyl)methylthio]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine 4-Chlorobenzyl 5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl sulfide [1,2,4]Triazolo[1,5-a]pyrimidine, 2-(4-chlorobenzylsulfanyl)-5,7-dimethyl-
Wiley ID 1438200
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