Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H17NO2.ClH |
| Molecular Weight | 255.741 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@@]1(CCCCN1)[C@H](C(O)=O)C2=CC=CC=C2
InChI
InChIKey=SCUMDQFFZZGUQY-MNMPKAIFSA-N
InChI=1S/C13H17NO2.ClH/c15-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11;/h1-3,6-7,11-12,14H,4-5,8-9H2,(H,15,16);1H/t11-,12-;/m1./s1
| Molecular Formula | C13H17NO2 |
| Molecular Weight | 219.2796 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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 15:23:49 UTC 2023
by
admin
on
Sat Dec 16 15:23:49 UTC 2023
|
| Record UNII |
MK6CT5PX5D
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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MK6CT5PX5D
Created by
admin on Sat Dec 16 15:23:49 UTC 2023 , Edited by admin on Sat Dec 16 15:23:49 UTC 2023
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741705-70-4
Created by
admin on Sat Dec 16 15:23:49 UTC 2023 , Edited by admin on Sat Dec 16 15:23:49 UTC 2023
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49801997
Created by
admin on Sat Dec 16 15:23:49 UTC 2023 , Edited by admin on Sat Dec 16 15:23:49 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
