Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C12H19NO3.C2H4O2 |
Molecular Weight | 285.3361 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)=O.CC(C)(C)NC[C@H](O)C1=CC=C(O)C(O)=C1
InChI
InChIKey=SVYBIDRTCKRNFA-MERQFXBCSA-N
InChI=1S/C12H19NO3.C2H4O2/c1-12(2,3)13-7-11(16)8-4-5-9(14)10(15)6-8;1-2(3)4/h4-6,11,13-16H,7H2,1-3H3;1H3,(H,3,4)/t11-;/m0./s1
Molecular Formula | C12H19NO3 |
Molecular Weight | 225.2842 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C2H4O2 |
Molecular Weight | 60.052 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:30:28 GMT 2023
by
admin
on
Fri Dec 15 16:30:28 GMT 2023
|
Record UNII |
FZ5KSX8I2K
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Record Status |
Validated (UNII)
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Record Version |
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-
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118796440
Created by
admin on Fri Dec 15 16:30:28 GMT 2023 , Edited by admin on Fri Dec 15 16:30:28 GMT 2023
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FZ5KSX8I2K
Created by
admin on Fri Dec 15 16:30:28 GMT 2023 , Edited by admin on Fri Dec 15 16:30:28 GMT 2023
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70858-21-8
Created by
admin on Fri Dec 15 16:30:28 GMT 2023 , Edited by admin on Fri Dec 15 16:30:28 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |