Debug Info

object
{15}
_id
:
GoL2iWkW1B8
spectrumID
:
GoL2iWkW1B8
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMS3X:290183:1
hasStructureAssignments
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false
properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
isFullSpectrum
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false
spectralOutlier
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false
compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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Diethyl 2-cyano-3-(pyrrolidin-1'-yl)but-2-ene-1,4-dioate
SpectraBase Compound ID D0yWk9p96Lv
InChI InChI=1S/C13H18N2O4/c1-3-18-12(16)10(9-14)11(13(17)19-4-2)15-7-5-6-8-15/h3-8H2,1-2H3/b11-10+
InChIKey UWARLTRFXXWTEX-ZHACJKMWSA-N
Mol Weight 266.3 g/mol
Molecular Formula C13H18N2O4
Exact Mass 266.126657 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GoL2iWkW1B8
Name Diethyl 2-cyano-3-(pyrrolidin-1'-yl)but-2-ene-1,4-dioate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O4
InChI InChI=1S/C13H18N2O4/c1-3-18-12(16)10(9-14)11(13(17)19-4-2)15-7-5-6-8-15/h3-8H2,1-2H3/b11-10+
InChIKey UWARLTRFXXWTEX-ZHACJKMWSA-N
Molecular Weight 266.297 g/mol
SMILES C1N(\C(=C\(C(=O)OCC)C#N)C(=O)OCC)CCC1
SPLASH splash10-006x-0920000000-b347292c13d3f7a91f44
Source of Spectrum H-92-1532-12e
Wiley ID 1693666
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