Debug Info

object
{24}
_id
:
4dB2VQXijfU
compoundID
:
4dB2VQXijfU
ambiguous
:
false
names
[1]
name
:
1,2,3,11a-Tetrahydro-2-(p-tolylsulfonyloxy)-11-cyclopentylamino-5H-pyrrolo[2,1-c][1,4]diazepin-5-one
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[2]
properties
{7}
spectrumSourcesMap
{2}
spectrumSourcesMapSuggestedOrder
[2]
otherEnantiomer1Compound
{1}
saltCompounds
[0]
isotopicCompounds
[0]
stereoisomerCompounds
[0]
stereoisomerSaltCompounds
[0]
similarCompounds
[10]
vendors
[0]
articles
[0]
lastUpdated
:
1735071411015
isDeprecated
:
false
productInfo
[0]
spectrumSourcesMapCountOriginal
:
2
spectrumSourcesMapCountFiltered
:
2

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1,2,3,11a-Tetrahydro-2-(p-tolylsulfonyloxy)-11-cyclopentylamino-5H-pyrrolo[2,1-c][1,4]diazepin-5-one
SpectraBase Compound ID 4dB2VQXijfU
InChI InChI=1S/C24H27N3O4S/c1-16-10-12-19(13-11-16)32(29,30)31-18-14-22-23(25-17-6-2-3-7-17)26-21-9-5-4-8-20(21)24(28)27(22)15-18/h4-5,8-13,17-18,22H,2-3,6-7,14-15H2,1H3,(H,25,26)/t18?,22-/m0/s1
InChIKey WOMRHBRERIVXGV-YSYXNDDBSA-N
Mol Weight 453.56 g/mol
Molecular Formula C24H27N3O4S
Exact Mass 453.172228 g/mol
Enantiomer InChIKey WOMRHBRERIVXGV-LMNIDFBRSA-N
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