Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C7H7NO2 |
| Molecular Weight | 137.136 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[N+]1=CC(=CC=C1)C([O-])=O
InChI
InChIKey=WWNNZCOKKKDOPX-UHFFFAOYSA-N
InChI=1S/C7H7NO2/c1-8-4-2-3-6(5-8)7(9)10/h2-5H,1H3
| Molecular Formula | C7H7NO2 |
| Molecular Weight | 137.136 |
| 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 18:01:28 UTC 2023
by
admin
on
Fri Dec 15 18:01:28 UTC 2023
|
| Record UNII |
3NQ9N60I00
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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18123
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208-620-5
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C009560
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TRIGONELLINE
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1686411
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535-83-1
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m11133
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DTXSID2026230
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7684
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5570
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3NQ9N60I00
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> CONSTITUENT ALWAYS PRESENT |
USP
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