Debug Info

object
{15}
_id
:
LtTt89EblR4
spectrumID
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LtTt89EblR4
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMS3X:168854:1
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
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false
spectralOutlier
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compound
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lastUpdated
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1735074081058
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2-(3-Butenyl)malonic acid, diethyl ester
SpectraBase Compound ID 6fIwdDR6WNc
InChI InChI=1S/C11H18O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h4,9H,1,5-8H2,2-3H3
InChIKey SNZFLJWANPHXKY-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtTt89EblR4
Name Diethyl 2-(But-3-enyl)propanedioate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h4,9H,1,5-8H2,2-3H3
InChIKey SNZFLJWANPHXKY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.200590062
Molecular Weight 214.261 g/mol
SMILES C(C(C(=O)OCC)CCC=C)(=O)OCC
SPLASH splash10-08mr-9700000000-aabc69a3790c16bf520b
Source of Spectrum CBD-2-861-48
Synonyms Diethyl 2-(but-3-en-1-yl)malonate
Wiley ID 1790216
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