Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H19NO3.H2O4S |
| Molecular Weight | 335.373 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.COC1=CC(CCN)=CC(OC)=C1OCC=C
InChI
InChIKey=FNQWAQMLICHTGP-UHFFFAOYSA-N
InChI=1S/C13H19NO3.H2O4S/c1-4-7-17-13-11(15-2)8-10(5-6-14)9-12(13)16-3;1-5(2,3)4/h4,8-9H,1,5-7,14H2,2-3H3;(H2,1,2,3,4)
| Molecular Formula | C13H19NO3 |
| Molecular Weight | 237.2949 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| 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 19:10:48 GMT 2023
by
admin
on
Sat Dec 16 19:10:48 GMT 2023
|
| Record UNII |
9JDS6JZL39
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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9JDS6JZL39
Created by
admin on Sat Dec 16 19:10:48 GMT 2023 , Edited by admin on Sat Dec 16 19:10:48 GMT 2023
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54110-94-0
Created by
admin on Sat Dec 16 19:10:48 GMT 2023 , Edited by admin on Sat Dec 16 19:10:48 GMT 2023
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163203595
Created by
admin on Sat Dec 16 19:10:48 GMT 2023 , Edited by admin on Sat Dec 16 19:10:48 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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