Debug Info

object
{24}
_id
:
GKAZGh6GS3F
compoundID
:
GKAZGh6GS3F
ambiguous
:
false
names
[0]
name
:
Choline p-toluenesulfonate, butyrate
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[2]
properties
{7}
spectrumSourcesMap
{2}
spectrumSourcesMapSuggestedOrder
[2]
parentCompound
{1}
saltCompounds
[2]
isotopicCompounds
[0]
stereoisomerCompounds
[0]
stereoisomerSaltCompounds
[0]
similarCompounds
[10]
vendors
[0]
articles
[0]
lastUpdated
:
1735071411015
isDeprecated
:
false
productInfo
[1]
spectrumSourcesMapCountOriginal
:
2
spectrumSourcesMapCountFiltered
:
2

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  • SearchSpectral
  • SearchStructure
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Choline p-toluenesulfonate, butyrate
SpectraBase Compound ID GKAZGh6GS3F
InChI InChI=1S/C9H20NO2.C7H8O3S/c1-5-6-9(11)12-8-7-10(2,3)4;1-6-2-4-7(5-3-6)11(8,9)10/h5-8H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey DZSWXVDFVYXLHS-UHFFFAOYSA-M
Mol Weight 345.45 g/mol
Molecular Formula C16H27NO5S
Exact Mass 345.160994 g/mol
Parent InChIKey YRIBGSCJIMXMPJ-UHFFFAOYSA-M
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