Details
Stereochemistry | ACHIRAL |
Molecular Formula | C21H25N.ClH |
Molecular Weight | 327.891 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CN(C\C=C\C#CC(C)(C)C)CC1=CC=CC2=CC=CC=C12
InChI
InChIKey=BWMISRWJRUSYEX-SZKNIZGXSA-N
InChI=1S/C21H25N.ClH/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19;/h5-7,9-14H,16-17H2,1-4H3;1H/b9-5+;
Molecular Formula | C21H25N |
Molecular Weight | 291.4299 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
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
Fri Dec 15 15:24:41 UTC 2023
by
admin
on
Fri Dec 15 15:24:41 UTC 2023
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Record UNII |
012C11ZU6G
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C514
Created by
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Code System | Code | Type | Description | ||
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SUB04723MIG
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DTXSID90229223
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012C11ZU6G
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235838
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admin on Fri Dec 15 15:24:41 UTC 2023 , Edited by admin on Fri Dec 15 15:24:41 UTC 2023
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78628-80-5
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C29492
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5282481
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DBSALT000470
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1643496
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759113
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77614
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012C11ZU6G
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616-640-4
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CHEMBL822
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admin on Fri Dec 15 15:24:41 UTC 2023 , Edited by admin on Fri Dec 15 15:24:41 UTC 2023
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m10569
Created by
admin on Fri Dec 15 15:24:41 UTC 2023 , Edited by admin on Fri Dec 15 15:24:41 UTC 2023
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PRIMARY | Merck Index | ||
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100000090624
Created by
admin on Fri Dec 15 15:24:41 UTC 2023 , Edited by admin on Fri Dec 15 15:24:41 UTC 2023
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PRIMARY |
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SUBSTANCE ASSAY DEFINED AMOUNT->SUBSTANCE |
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EP
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PARENT -> SALT/SOLVATE |
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SUBSTANCE ASSAY DEFINED AMOUNT->SUBSTANCE |
ASSAY (HPLC)
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
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IMPURITY -> PARENT |
For the calculation of contents, multiply the peak areas by 0.5
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
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|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
|
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IMPURITY -> PARENT |
UNSPECIFIED
EP
|
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|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
|
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IMPURITY -> PARENT |
UNSPECIFIED
EP
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IMPURITY -> PARENT |
UNSPECIFIED
EP
|
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IMPURITY -> PARENT |
UNSPECIFIED
EP
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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