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(2,3-13C2)acetylenedicarboxylic acid
SpectraBase Compound ID AO4ZXJ81EGA
InChI InChI=1S/C4H2O4/c5-3(6)1-2-4(7)8/h(H,5,6)(H,7,8)/i1+1,2+1
InChIKey YTIVTFGABIZHHX-ZDOIIHCHSA-N
Mol Weight 116.04 g/mol
Molecular Formula C213C2H2O4
Exact Mass 116.002018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gjUTfFqa3w
Name (2,3-13C2)acetylenedicarboxylic acid
Comments Original formula: C2[13C]2H2O4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H2O4
InChI InChI=1S/C4H2O4/c5-3(6)1-2-4(7)8/h(H,5,6)(H,7,8)/i1+1,2+1
InChIKey YTIVTFGABIZHHX-ZDOIIHCHSA-N
Molecular Weight 116.041 g/mol
SMILES OC([13C]#[13C]C(=O)O)=O
SPLASH splash10-0udi-9000000000-61149c687216b968fa72
Source of Spectrum JA-50-1159-0
Synonyms 2-Butynedioic acid-13C2 Acetylene-13C2 dicarboxylic acid 2-Butynedioic acid - [13C]-labelled
Wiley ID 1124069