Debug Info

object
{24}
_id
:
KetiSD5WW18
compoundID
:
KetiSD5WW18
ambiguous
:
false
names
[0]
name
:
(5S,7S,7aR)-5-ethoxy-7-hydroxy-3-thioxo-7-(trifluoromethyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[1]
properties
{7}
spectrumSourcesMap
{1}
spectrumSourcesMapSuggestedOrder
[1]
otherEnantiomer1Compound
{1}
saltCompounds
[0]
isotopicCompounds
[0]
stereoisomerCompounds
[0]
stereoisomerSaltCompounds
[0]
similarCompounds
[10]
vendors
[0]
articles
[0]
lastUpdated
:
1735071411015
isDeprecated
:
false
productInfo
[0]
spectrumSourcesMapCountOriginal
:
1
spectrumSourcesMapCountFiltered
:
1

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  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
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(5S,7S,7aR)-5-ethoxy-7-hydroxy-3-thioxo-7-(trifluoromethyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
SpectraBase Compound ID KetiSD5WW18
InChI InChI=1S/C9H11F3N2O3S/c1-2-17-4-3-8(16,9(10,11)12)5-6(15)13-7(18)14(4)5/h4-5,16H,2-3H2,1H3,(H,13,15,18)/t4-,5-,8-/m0/s1
InChIKey IRBXXLUBGSKYAR-YQJDLUKNSA-N
Mol Weight 284.25 g/mol
Molecular Formula C9H11F3N2O3S
Exact Mass 284.044248 g/mol
Enantiomer InChIKey IRBXXLUBGSKYAR-OKMMGKLZSA-N
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