Debug Info

object
{24}
_id
:
8cow3S42adz
compoundID
:
8cow3S42adz
ambiguous
:
false
names
[1]
name
:
cis-4-Bromo-8,8-dimethyl-5-oxobicyclo-[5.1.0]-oct-3-ene-1,7-dicarboxylic-acid
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[3]
properties
{7}
spectrumSourcesMap
{3}
spectrumSourcesMapSuggestedOrder
[3]
otherEnantiomer1Compound
{1}
saltCompounds
[0]
isotopicCompounds
[0]
stereoisomerCompounds
[0]
stereoisomerSaltCompounds
[0]
similarCompounds
[10]
vendors
[0]
articles
[1]
lastUpdated
:
1735071411015
isDeprecated
:
false
productInfo
[0]
spectrumSourcesMapCountOriginal
:
3
spectrumSourcesMapCountFiltered
:
3

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  • SearchStructure
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cis-4-Bromo-8,8-dimethyl-5-oxobicyclo-[5.1.0]-oct-3-ene-1,7-dicarboxylic-acid
SpectraBase Compound ID 8cow3S42adz
InChI InChI=1S/C12H13BrO5/c1-10(2)11(8(15)16)4-3-6(13)7(14)5-12(10,11)9(17)18/h3H,4-5H2,1-2H3,(H,15,16)(H,17,18)/t11-,12+/m0/s1
InChIKey LYMOOBCKIGHUTB-NWDGAFQWSA-N
Mol Weight 317.14 g/mol
Molecular Formula C12H13BrO5
Exact Mass 315.994637 g/mol
Enantiomer InChIKey LYMOOBCKIGHUTB-NEPJUHHUSA-N
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  • (1S,7R)-4-bromo-8,8-dimethyl-5-oxobicyclo[5.1.0]oct-3-ene-1,7-dicarboxylic acid
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