Debug Info

object
{23}
_id
:
AQw71TLO3VN
compoundID
:
AQw71TLO3VN
ambiguous
:
false
names
[1]
name
:
11,23-dichloro-5,17-octano-25,26,27,28-tetrahydroxycalix[4]arene
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[1]
properties
{7}
spectrumSourcesMap
{1}
spectrumSourcesMapSuggestedOrder
[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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11,23-dichloro-5,17-octano-25,26,27,28-tetrahydroxycalix[4]arene
SpectraBase Compound ID AQw71TLO3VN
InChI InChI=1S/C36H36Cl2O4/c37-31-17-27-13-23-9-21-7-5-3-1-2-4-6-8-22-11-25(15-29(19-31)35(27)41)34(40)26(12-22)16-30-20-32(38)18-28(36(30)42)14-24(10-21)33(23)39/h9-12,17-20,39-42H,1-8,13-16H2
InChIKey LPEOERLJYSANBN-UHFFFAOYSA-N
Mol Weight 603.6 g/mol
Molecular Formula C36H36Cl2O4
Exact Mass 602.199065 g/mol
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  • 20,29-dichlorohexacyclo[12.11.7.1(3,24).1(12,16).1(18,22).1(27,31)]hexatriaconta-1,3(34),12(36),13,15,18(35),19,21,24,27(33),28,30-dodecaene-15,25,33,35-tetrol
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