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Details

Stereochemistry RACEMIC
Molecular Formula C5H6O3
Molecular Weight 114.0993
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [(2Z)-3-Methyl-4-oxo-2-butenoic acid]

SMILES

CC1=CC(=O)OC1O

InChI

InChIKey=XRNPHZPFAWLRNJ-UHFFFAOYSA-N
InChI=1S/C5H6O3/c1-3-2-4(6)8-5(3)7/h2,5,7H,1H3

HIDE SMILES / InChI

Molecular Formula C5H6O3
Molecular Weight 114.0993
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:21:29 GMT 2025
Edited
by admin
on Wed Apr 02 19:21:29 GMT 2025
Record UNII
62ZL28267H
Record Status alternative
Record Version
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Related Record Type Details
Primary Definition