CID 3059693

77006-39-4

Structural Information

Molecular Formula
C13H11Cl2N3OS
SMILES
CC1=C(SC2=NCCN12)C(=O)NC3=C(C=CC=C3Cl)Cl
InChI
InChI=1S/C13H11Cl2N3OS/c1-7-11(20-13-16-5-6-18(7)13)12(19)17-10-8(14)3-2-4-9(10)15/h2-4H,5-6H2,1H3,(H,17,19)
InChIKey
QCOOUUGPNWTURI-UHFFFAOYSA-N
Compound name
N-(2,6-dichlorophenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

327.0 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.00728 173.6
[M+Na]+ 349.98922 185.1
[M-H]- 325.99272 179.4
[M+NH4]+ 345.03382 191.9
[M+K]+ 365.96316 178.8
[M+H-H2O]+ 309.99726 168.0
[M+HCOO]- 371.99820 181.4
[M+CH3COO]- 386.01385 185.1
[M+Na-2H]- 347.97467 171.3
[M]+ 326.99945 178.9
[M]- 327.00055 178.9
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.