Details
Stereochemistry | ACHIRAL |
Molecular Formula | C13H16F3NO2 |
Molecular Weight | 275.2668 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COCCCC\C(C1=CC=C(C=C1)C(F)(F)F)=N/O
InChI
InChIKey=UDCRPPVSQRFBKJ-SFQUDFHCSA-N
InChI=1S/C13H16F3NO2/c1-19-9-3-2-4-12(17-18)10-5-7-11(8-6-10)13(14,15)16/h5-8,18H,2-4,9H2,1H3/b17-12+
Molecular Formula | C13H16F3NO2 |
Molecular Weight | 275.2668 |
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
Edited
Sat Dec 16 05:29:49 GMT 2023
by
admin
on
Sat Dec 16 05:29:49 GMT 2023
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Record UNII |
X5002XN6WQ
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Record Status |
Validated (UNII)
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Record Version |
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-
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11346398
Created by
admin on Sat Dec 16 05:29:49 GMT 2023 , Edited by admin on Sat Dec 16 05:29:49 GMT 2023
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X5002XN6WQ
Created by
admin on Sat Dec 16 05:29:49 GMT 2023 , Edited by admin on Sat Dec 16 05:29:49 GMT 2023
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88699-84-7
Created by
admin on Sat Dec 16 05:29:49 GMT 2023 , Edited by admin on Sat Dec 16 05:29:49 GMT 2023
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PRIMARY |
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PARENT -> METABOLITE |
MINOR
URINE
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PARENT -> IMPURITY |