CID 369510

Nsc641290

Structural Information

Molecular Formula
C11H9N3S
SMILES
CC1=CSC2=NC(=CN12)C3=CC=NC=C3
InChI
InChI=1S/C11H9N3S/c1-8-7-15-11-13-10(6-14(8)11)9-2-4-12-5-3-9/h2-7H,1H3
InChIKey
KBZPNUKMVHLHQJ-UHFFFAOYSA-N
Compound name
3-methyl-6-pyridin-4-ylimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.05171 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.05899 143.9
[M+Na]+ 238.04093 157.5
[M-H]- 214.04443 149.7
[M+NH4]+ 233.08553 164.6
[M+K]+ 254.01487 153.2
[M+H-H2O]+ 198.04897 137.0
[M+HCOO]- 260.04991 163.8
[M+CH3COO]- 274.06556 158.5
[M+Na-2H]- 236.02638 147.0
[M]+ 215.05116 149.1
[M]- 215.05226 149.1
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.