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[1,3-13C2]-Malonic acxid diethyl ester
SpectraBase Compound ID 7PAuUrFqwM1
InChI InChI=1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3/i6+1,7+1
InChIKey IYXGSMUGOJNHAZ-AKZCFXPHSA-N
Mol Weight 162.15 g/mol
Molecular Formula C513C2H12O4
Exact Mass 162.080269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZIRvxAzrs
Name [1,3-13C2]-Malonic acxid diethyl ester
Comments Original formula: C5[13C]2H12O4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O4
InChI InChI=1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3/i6+1,7+1
InChIKey IYXGSMUGOJNHAZ-AKZCFXPHSA-N
Molecular Weight 162.154 g/mol
SMILES C([13C](=O)OCC)[13C](=O)OCC
SPLASH splash10-00kr-4900000000-acbc0a2b661062572a14
Source of Spectrum SO-0-588-3
Synonyms Propanedioic acid diethyl ester Diethyl propanedioate
Wiley ID 1537719