CID 58266

4-(dimethylamino)methyleneamino-2,1,3-benzothiadiazole

Structural Information

Molecular Formula
C9H10N4S
SMILES
CN(C)C=NC1=CC=CC2=NSN=C21
InChI
InChI=1S/C9H10N4S/c1-13(2)6-10-7-4-3-5-8-9(7)12-14-11-8/h3-6H,1-2H3
InChIKey
XGSDDADAQMHBAA-UHFFFAOYSA-N
Compound name
N'-(2,1,3-benzothiadiazol-4-yl)-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06262 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.06990 141.6
[M+Na]+ 229.05184 154.1
[M+NH4]+ 224.09644 150.8
[M+K]+ 245.02578 147.0
[M-H]- 205.05534 145.0
[M+Na-2H]- 227.03729 149.1
[M]+ 206.06207 144.7
[M]- 206.06317 144.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.