CID 3524848

6-iodobenzo[d]thiazol-2-amine

Structural Information

Molecular Formula
C7H5IN2S
SMILES
C1=CC2=C(C=C1I)SC(=N2)N
InChI
InChI=1S/C7H5IN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKey
WMKLSFIAHMBOTP-UHFFFAOYSA-N
Compound name
6-iodo-1,3-benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

52
Patents

275.9218 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.92908 140.3
[M+Na]+ 298.91102 145.9
[M+NH4]+ 293.95562 146.0
[M+K]+ 314.88496 142.2
[M-H]- 274.91452 137.3
[M+Na-2H]- 296.89647 134.5
[M]+ 275.92125 139.7
[M]- 275.92235 139.7
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

patents stripe