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 |