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Details

Stereochemistry ACHIRAL
Molecular Formula C18H26O3
Molecular Weight 290.3972
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [5-(2,5-DIMETHYL-4-(PROP-1-EN-1-YL)PHENOXY)-2,2-DIMETHYLPENTANOIC ACID]

SMILES

CC=CC1=C(C)C=C(OCCCC(C)(C)C(O)=O)C(C)=C1

InChI

InChIKey=ZWBXHPOXWIJOJR-SOFGYWHQSA-N
InChI=1S/C18H26O3/c1-6-8-15-11-14(3)16(12-13(15)2)21-10-7-9-18(4,5)17(19)20/h6,8,11-12H,7,9-10H2,1-5H3,(H,19,20)/b8-6+

HIDE SMILES / InChI

Molecular Formula C18H26O3
Molecular Weight 290.3972
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:37:49 GMT 2023
Edited
by admin
on Sat Dec 16 18:37:49 GMT 2023
Record UNII
E4G86Y7QNU
Record Status alternative
Record Version
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