U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry RACEMIC
Molecular Formula C13H18O2
Molecular Weight 206.2808
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-BUTYLHYDRATROPIC ACID

SMILES

CCCCC1=CC=C(C=C1)C(C)C(O)=O

InChI

InChIKey=FEFPDZIYEWFQFK-UHFFFAOYSA-N
InChI=1S/C13H18O2/c1-3-4-5-11-6-8-12(9-7-11)10(2)13(14)15/h6-10H,3-5H2,1-2H3,(H,14,15)

HIDE SMILES / InChI

Approval Year