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Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O5S
Molecular Weight 230.238
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-MESYL-O-ANISIC ACID

SMILES

COC1=CC=C(C=C1C(O)=O)S(C)(=O)=O

InChI

InChIKey=BXWLVQXAFBWKSR-UHFFFAOYSA-N
InChI=1S/C9H10O5S/c1-14-8-4-3-6(15(2,12)13)5-7(8)9(10)11/h3-5H,1-2H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C9H10O5S
Molecular Weight 230.238
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
HL1OU1ENK7
Record Status Validated (UNII)
Record Version