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Details

Stereochemistry ACHIRAL
Molecular Formula C13H13NO2
Molecular Weight 215.2478
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-CYANO-3-PHENYLCROTONIC ACID ETHYL ESTER

SMILES

CCOC(=O)C(\C#N)=C(\C)C1=CC=CC=C1

InChI

InChIKey=AJDOTEWSLNGINB-BENRWUELSA-N
InChI=1S/C13H13NO2/c1-3-16-13(15)12(9-14)10(2)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3/b12-10-

HIDE SMILES / InChI

Molecular Formula C13H13NO2
Molecular Weight 215.2478
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
9429M24CJB
Record Status Validated (UNII)
Record Version