CID 369507

2507-80-4

Structural Information

Molecular Formula
C12H10N2OS
SMILES
COC1=CC=C(C=C1)C2=CN3C=CSC3=N2
InChI
InChI=1S/C12H10N2OS/c1-15-10-4-2-9(3-5-10)11-8-14-6-7-16-12(14)13-11/h2-8H,1H3
InChIKey
DHZNOEONHMHDQZ-UHFFFAOYSA-N
Compound name
6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

65
Patents

230.05139 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.05867 147.9
[M+Na]+ 253.04061 160.8
[M-H]- 229.04411 155.0
[M+NH4]+ 248.08521 169.3
[M+K]+ 269.01455 156.9
[M+H-H2O]+ 213.04865 141.6
[M+HCOO]- 275.04959 169.0
[M+CH3COO]- 289.06524 162.7
[M+Na-2H]- 251.02606 150.9
[M]+ 230.05084 154.3
[M]- 230.05194 154.3
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