Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C10H12NO.C7H7O3S |
| Molecular Weight | 333.402 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.CC[N+]2=C(C)OC3=C2C=CC=C3
InChI
InChIKey=VUQSSSLPKYLMFL-UHFFFAOYSA-M
InChI=1S/C10H12NO.C7H8O3S/c1-3-11-8(2)12-10-7-5-4-6-9(10)11;1-6-2-4-7(5-3-6)11(8,9)10/h4-7H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
| Molecular Formula | C10H12NO |
| Molecular Weight | 162.2084 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C7H7O3S |
| Molecular Weight | 171.194 |
| 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
Wed Apr 02 20:19:09 GMT 2025
by
admin
on
Wed Apr 02 20:19:09 GMT 2025
|
| Record UNII |
PA57PCQ259
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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DTXSID0069387
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PA57PCQ259
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262-069-5
Created by
admin on Wed Apr 02 20:19:09 GMT 2025 , Edited by admin on Wed Apr 02 20:19:09 GMT 2025
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108893
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admin on Wed Apr 02 20:19:09 GMT 2025 , Edited by admin on Wed Apr 02 20:19:09 GMT 2025
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60126-36-5
Created by
admin on Wed Apr 02 20:19:09 GMT 2025 , Edited by admin on Wed Apr 02 20:19:09 GMT 2025
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