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Butanoic-1,3-13C2 acid, 3-oxo-, ethyl ester
SpectraBase Compound ID K4tiPHCB1YV
InChI InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3/i5+1,6+1
InChIKey XYIBRDXRRQCHLP-MPOCSFTDSA-N
Mol Weight 132.13 g/mol
Molecular Formula C413C2H10O3
Exact Mass 132.069704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCFsNPqIFF2
Name Butanoic-1,3-13C2 acid, 3-oxo-, ethyl ester
CAS Registry Number 77504-73-5
Comments Original formula: C4[13C]2H10O3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O3
InChI InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3/i5+1,6+1
InChIKey XYIBRDXRRQCHLP-MPOCSFTDSA-N
Molecular Weight 132.128 g/mol
SMILES C([13C](=O)OCC)[13C](=O)C
SPLASH splash10-0006-9000000000-73676a126e7ea2571268
Source of Spectrum KC-1988-3204-0
Synonyms Ethyl[1,3-bis(¹³C)]acetoacetate
Wiley ID 1132549