Debug Info

object
{25}
_id
:
4Wm7ZMECR8E
compoundID
:
4Wm7ZMECR8E
ambiguous
:
false
names
[1]
name
:
alpha-{4-[(E)-3-CYCLOHEXYL-3S-HYDROXYPROPENYL]HEXAHYDRO-5alpha-HYDROXY-(Z)-3alpha,6aalpha-2H-CYCLOPENTA[b]FURAN-2-YLIDENE}-m-TOLUIC ACID, MONOSODIUM SALT
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[2]
properties
{7}
spectrumSourcesMap
{2}
spectrumSourcesMapSuggestedOrder
[2]
parentCompound
{1}
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

Logged In :

Authorized Features

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  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
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alpha-{4-[(E)-3-CYCLOHEXYL-3S-HYDROXYPROPENYL]HEXAHYDRO-5alpha-HYDROXY-(Z)-3alpha,6aalpha-2H-CYCLOPENTA[b]FURAN-2-YLIDENE}-m-TOLUIC ACID, MONOSODIUM SALT
SpectraBase Compound ID 4Wm7ZMECR8E
InChI InChI=1S/C24H30O5.Na/c25-21(16-6-2-1-3-7-16)10-9-19-20-13-18(29-23(20)14-22(19)26)12-15-5-4-8-17(11-15)24(27)28;/h4-5,8-12,16,19-23,25-26H,1-3,6-7,13-14H2,(H,27,28);/q;+1/p-1/b10-9+,18-12-;/t19?,20-,21-,22-,23+;/m1./s1
InChIKey KPQVOJYDUCZQEQ-KXWOLWCYSA-M
Mol Weight 420.48076928 g/mol
Molecular Formula C24H29NaO5
Exact Mass 420.191268 g/mol
Parent InChIKey ZLJOKYGJNOQXDP-YCXJRALGSA-M
Enantiomer InChIKey KPQVOJYDUCZQEQ-LMEXSASWSA-M
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