CID 3048922

Imidazo(2,1-b)thiazole-2-carboxamide, 5,6-dihydro-n-(o-fluorophenyl)-3-methyl-, hydrochloride

Structural Information

Molecular Formula
C13H12FN3OS
SMILES
CC1=C(SC2=NCCN12)C(=O)NC3=CC=CC=C3F
InChI
InChI=1S/C13H12FN3OS/c1-8-11(19-13-15-6-7-17(8)13)12(18)16-10-5-3-2-4-9(10)14/h2-5H,6-7H2,1H3,(H,16,18)
InChIKey
ZXEWFZLBJGVFCX-UHFFFAOYSA-N
Compound name
N-(2-fluorophenyl)-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

2
Patents

277.0685 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.07578 159.8
[M+Na]+ 300.05772 169.8
[M-H]- 276.06122 164.8
[M+NH4]+ 295.10232 178.7
[M+K]+ 316.03166 165.4
[M+H-H2O]+ 260.06576 152.3
[M+HCOO]- 322.06670 176.5
[M+CH3COO]- 336.08235 172.0
[M+Na-2H]- 298.04317 159.1
[M]+ 277.06795 161.1
[M]- 277.06905 161.1
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