Debug Info

object
{15}
_id
:
K1G5D6hujjW
spectrumID
:
K1G5D6hujjW
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMS3X:67030:1
hasStructureAssignments
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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-D3-Methylthiopurine
SpectraBase Compound ID 3h2xVlBXqxP
InChI InChI=1S/C6H6N4S/c1-11-6-7-2-4-5(10-6)9-3-8-4/h2-3H,1H3,(H,7,8,9,10)/i1D3
InChIKey GEVCSRLIETZLTD-FIBGUPNXSA-N
Mol Weight 169.22 g/mol
Molecular Formula C6H3D3N4S
Exact Mass 169.050148 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1G5D6hujjW
Name 2-D3-Methylthiopurine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H3D3N4S
InChI InChI=1S/C6H6N4S/c1-11-6-7-2-4-5(10-6)9-3-8-4/h2-3H,1H3,(H,7,8,9,10)/i1D3
InChIKey GEVCSRLIETZLTD-FIBGUPNXSA-N
Molecular Weight 169.220 g/mol
SMILES [nH]1cnc2c1cnc(n2)SC([D])([D])[D]
SPLASH splash10-01b9-9800000000-294907cf8f9944699979
Source of Spectrum OS-5-114-0
Wiley ID 131201
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