CID 333032

Nsc332740

Structural Information

Molecular Formula
C7H7N3OS
SMILES
CC1=C(N2C=CSC2=N1)C(=O)N
InChI
InChI=1S/C7H7N3OS/c1-4-5(6(8)11)10-2-3-12-7(10)9-4/h2-3H,1H3,(H2,8,11)
InChIKey
UJMIGFGAFXZFKU-UHFFFAOYSA-N
Compound name
6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

181.03099 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.03827 135.2
[M+Na]+ 204.02021 147.5
[M-H]- 180.02371 138.7
[M+NH4]+ 199.06481 158.0
[M+K]+ 219.99415 144.9
[M+H-H2O]+ 164.02825 129.7
[M+HCOO]- 226.02919 155.5
[M+CH3COO]- 240.04484 149.9
[M+Na-2H]- 202.00566 137.2
[M]+ 181.03044 139.2
[M]- 181.03154 139.2
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.