CID 369512

Nsc641292

Structural Information

Molecular Formula
C12H10N2OS2
SMILES
CSC1=CC(=C(C=C1)C2=CN3C=CSC3=N2)O
InChI
InChI=1S/C12H10N2OS2/c1-16-8-2-3-9(11(15)6-8)10-7-14-4-5-17-12(14)13-10/h2-7,15H,1H3
InChIKey
VJWLTFNGUIFFOD-UHFFFAOYSA-N
Compound name
2-imidazo[2,1-b][1,3]thiazol-6-yl-5-methylsulfanylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.02347 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.03075 153.7
[M+Na]+ 285.01269 167.7
[M-H]- 261.01619 159.7
[M+NH4]+ 280.05729 173.9
[M+K]+ 300.98663 162.0
[M+H-H2O]+ 245.02073 149.1
[M+HCOO]- 307.02167 168.1
[M+CH3COO]- 321.03732 167.5
[M+Na-2H]- 282.99814 153.9
[M]+ 262.02292 160.1
[M]- 262.02402 160.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.