Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C9H13N.H2O4S |
| Molecular Weight | 236.303 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.[2H]C([2H])([2H])[C@H](N)CC1=CC=CC=C1
InChI
InChIKey=SOFQDLYSFOWTJX-IUDMXIBMSA-N
InChI=1S/C9H13N.H2O4S/c1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/t8-;/m0./s1/i1D3;
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C9H13N |
| Molecular Weight | 138.2247 |
| 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
Mon Mar 31 22:26:00 GMT 2025
by
admin
on
Mon Mar 31 22:26:00 GMT 2025
|
| Record UNII |
579LE94N3N
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English | ||
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Common Name | English |
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76959335
Created by
admin on Mon Mar 31 22:26:00 GMT 2025 , Edited by admin on Mon Mar 31 22:26:00 GMT 2025
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63427-74-7
Created by
admin on Mon Mar 31 22:26:00 GMT 2025 , Edited by admin on Mon Mar 31 22:26:00 GMT 2025
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579LE94N3N
Created by
admin on Mon Mar 31 22:26:00 GMT 2025 , Edited by admin on Mon Mar 31 22:26:00 GMT 2025
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PRIMARY |