Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C7H7N2O.HO4S |
| Molecular Weight | 232.214 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS([O-])(=O)=O.OCC1=CC=C(C=C1)[N+]#N
InChI
InChIKey=INGWLPUDABKDQT-UHFFFAOYSA-M
InChI=1S/C7H7N2O.H2O4S/c8-9-7-3-1-6(5-10)2-4-7;1-5(2,3)4/h1-4,10H,5H2;(H2,1,2,3,4)/q+1;/p-1
| Molecular Formula | C7H7N2O |
| Molecular Weight | 135.1433 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | HO4S |
| Molecular Weight | 97.071 |
| Charge | -1 |
| 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
Mon Mar 31 22:29:54 GMT 2025
by
admin
on
Mon Mar 31 22:29:54 GMT 2025
|
| Record UNII |
UF6514B4IM
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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168701-53-9
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UF6514B4IM
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154808
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admin on Mon Mar 31 22:29:54 GMT 2025 , Edited by admin on Mon Mar 31 22:29:54 GMT 2025
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DTXSID30168602
Created by
admin on Mon Mar 31 22:29:54 GMT 2025 , Edited by admin on Mon Mar 31 22:29:54 GMT 2025
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