Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C12H13NO3 |
| Molecular Weight | 219.2365 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O=C1CCC2=C(N1)C=CC=C2OCC3CO3
InChI
InChIKey=VQTWQOBNPISQPG-UHFFFAOYSA-N
InChI=1S/C12H13NO3/c14-12-5-4-9-10(13-12)2-1-3-11(9)16-7-8-6-15-8/h1-3,8H,4-7H2,(H,13,14)
| Molecular Formula | C12H13NO3 |
| Molecular Weight | 219.2365 |
| 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
Wed Apr 02 11:27:48 GMT 2025
by
admin
on
Wed Apr 02 11:27:48 GMT 2025
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| Record UNII |
2WA9ZP4G9Y
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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51781-14-7
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12899423
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2WA9ZP4G9Y
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DTXSID30512545
Created by
admin on Wed Apr 02 11:27:48 GMT 2025 , Edited by admin on Wed Apr 02 11:27:48 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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