Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C9H9NO3.C5H13NO |
Molecular Weight | 282.3355 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](O)CN(C)C.CC(=O)NC1=CC=C(C=C1)C(O)=O
InChI
InChIKey=FJFQBKRMSCKTSE-ZSCHJXSPSA-N
InChI=1S/C9H9NO3.C5H13NO/c1-6(11)10-8-4-2-7(3-5-8)9(12)13;1-5(7)4-6(2)3/h2-5H,1H3,(H,10,11)(H,12,13);5,7H,4H2,1-3H3/t;5-/m.0/s1
Molecular Formula | C5H13NO |
Molecular Weight | 103.1628 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C9H9NO3 |
Molecular Weight | 179.1727 |
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
Sat Dec 16 10:38:19 GMT 2023
by
admin
on
Sat Dec 16 10:38:19 GMT 2023
|
Record UNII |
WH5NCN796Q
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
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Systematic Name | English |
Code System | Code | Type | Description | ||
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76964719
Created by
admin on Sat Dec 16 10:38:19 GMT 2023 , Edited by admin on Sat Dec 16 10:38:19 GMT 2023
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PRIMARY | |||
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WH5NCN796Q
Created by
admin on Sat Dec 16 10:38:19 GMT 2023 , Edited by admin on Sat Dec 16 10:38:19 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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RACEMATE -> ENANTIOMER |