CID 13758219

Brn 5589306

Structural Information

Molecular Formula
C10H12ClN5OS
SMILES
CN(C)CC(=O)N/N=C/C1=C(N=C2N1C=CS2)Cl
InChI
InChI=1S/C10H12ClN5OS/c1-15(2)6-8(17)14-12-5-7-9(11)13-10-16(7)3-4-18-10/h3-5H,6H2,1-2H3,(H,14,17)/b12-5+
InChIKey
BPQPFSSGIFMVBP-LFYBBSHMSA-N
Compound name
N-[(E)-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]-2-(dimethylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.0451 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.05238 163.8
[M+Na]+ 308.03432 174.1
[M-H]- 284.03782 169.8
[M+NH4]+ 303.07892 183.9
[M+K]+ 324.00826 171.1
[M+H-H2O]+ 268.04236 156.7
[M+HCOO]- 330.04330 182.9
[M+CH3COO]- 344.05895 207.2
[M+Na-2H]- 306.01977 165.9
[M]+ 285.04455 172.1
[M]- 285.04565 172.1
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.