Details
Stereochemistry | ACHIRAL |
Molecular Formula | C14H13N2.C2H5O4S |
Molecular Weight | 334.39 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOS([O-])(=O)=O.CC[N+]1=C2C=CC=CC2=NC3=C1C=CC=C3
InChI
InChIKey=VDJKJPMLWJWQIH-UHFFFAOYSA-M
InChI=1S/C14H13N2.C2H6O4S/c1-2-16-13-9-5-3-7-11(13)15-12-8-4-6-10-14(12)16;1-2-6-7(3,4)5/h3-10H,2H2,1H3;2H2,1H3,(H,3,4,5)/q+1;/p-1
Molecular Formula | C14H13N2 |
Molecular Weight | 209.2664 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C2H5O4S |
Molecular Weight | 125.124 |
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
Fri Dec 15 17:51:41 GMT 2023
by
admin
on
Fri Dec 15 17:51:41 GMT 2023
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Record UNII |
9A2K3Z3B9U
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Record Status |
Validated (UNII)
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Record Version |
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-
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9A2K3Z3B9U
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402863
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82688
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10510-77-7
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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