Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.2689 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCN[C@H](C)CC1=CC2=C(OCO2)C=C1
InChI
InChIKey=PVXVWWANJIWJOO-SECBINFHSA-N
InChI=1S/C12H17NO2/c1-3-13-9(2)6-10-4-5-11-12(7-10)15-8-14-11/h4-5,7,9,13H,3,6,8H2,1-2H3/t9-/m1/s1
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.2689 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:48:38 UTC 2023
by
admin
on
Sat Dec 16 10:48:38 UTC 2023
|
| Record UNII |
PVK7G754HO
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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114612-27-0
Created by
admin on Sat Dec 16 10:48:38 UTC 2023 , Edited by admin on Sat Dec 16 10:48:38 UTC 2023
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13909091
Created by
admin on Sat Dec 16 10:48:38 UTC 2023 , Edited by admin on Sat Dec 16 10:48:38 UTC 2023
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PVK7G754HO
Created by
admin on Sat Dec 16 10:48:38 UTC 2023 , Edited by admin on Sat Dec 16 10:48:38 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> ENANTIOMER |
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RACEMATE -> ENANTIOMER |
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SALT/SOLVATE -> PARENT |
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