Debug Info

object
{15}
_id
:
JFWKnusG8mW
spectrumID
:
JFWKnusG8mW
cost
:
1
specType
:
131072
xnmrNucleus
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0
dbLocation
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WDD1X:4038:1
hasStructureAssignments
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false
properties
{18}
analyticalTechnique
:
MS (GC)
analyticalTechniqueLongName
:
Mass Spectrum (GC)
isFullSpectrum
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false
spectralOutlier
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false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

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SpectraBase Compound ID 1RN7F9utL0h
InChI InChI=1S/C8H8ClN/c1-10-6-7-4-2-3-5-8(7)9/h2-5H,1,6H2
InChIKey KGOGJOUFSKSSTJ-UHFFFAOYSA-N
Mol Weight 153.61 g/mol
Molecular Formula C8H8ClN
Exact Mass 153.034527 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFWKnusG8mW
Name Ticlopidine-M/A
Classification Pharmaceutical drug metabolite
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 153.034526962 u
Formula C8H8ClN
InChI InChI=1S/C8H8ClN/c1-10-6-7-4-2-3-5-8(7)9/h2-5H,1,6H2
InChIKey KGOGJOUFSKSSTJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 153.612 g/mol
Nominal Mass 153 u
Quality 808
Retention Index 1135
SMILES C=1(C(=CC=CC1)Cl)CN=C
SPLASH splash10-004i-5900000000-e3030e285e71ee29d56b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Clopidogrel-M/A N-(2-chlorobenzyl)methanimine
Technique GC/MS
Wiley ID DD2024_004038
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