Details
Stereochemistry | RACEMIC |
Molecular Formula | C13H14O3 |
Molecular Weight | 218.2485 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC(O)COC1=C2C=CC=CC2=CC=C1
InChI
InChIKey=BYNNMWGWFIGTIC-UHFFFAOYSA-N
InChI=1S/C13H14O3/c14-8-11(15)9-16-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11,14-15H,8-9H2
Molecular Formula | C13H14O3 |
Molecular Weight | 218.2485 |
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
Edited
Sat Dec 16 10:50:02 UTC 2023
by
admin
on
Sat Dec 16 10:50:02 UTC 2023
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Record UNII |
FU45BO16RF
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Record Status |
Validated (UNII)
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Record Version |
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-
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2105554
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37369
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FU45BO16RF
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36112-95-5
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1576016
Created by
admin on Sat Dec 16 10:50:02 UTC 2023 , Edited by admin on Sat Dec 16 10:50:02 UTC 2023
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Related Record | Type | Details | ||
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
URINE
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Related Record | Type | Details | ||
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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