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Propanedioic-1,3-13C2 acid
SpectraBase Compound ID 6EIAL1iYnhM
InChI InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/i2+1,3+1
InChIKey OFOBLEOULBTSOW-SUEIGJEOSA-N
Mol Weight 106.05 g/mol
Molecular Formula C13C2H4O4
Exact Mass 106.017668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NyWZEHq71r
Name Propanedioic-1,3-13C2 acid
CAS Registry Number 99524-14-8
Comments Original formula: C[13C]2H4O4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H4O4
InChI InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/i2+1,3+1
InChIKey OFOBLEOULBTSOW-SUEIGJEOSA-N
Molecular Weight 106.046 g/mol
SMILES O[13C](C[13C](=O)O)=O
SPLASH splash10-0002-9000000000-8b31759c444d643ed47e
Source of Spectrum B-42-1341-0
Synonyms [di-1,3-(13)C]-malonic acid [di-1,3-(13)C]-propanedioic acid
Wiley ID 1120850