CID 4680249

449799-30-8

Structural Information

Molecular Formula
C6H7N3S
SMILES
C1=CSC2=NC(=CN21)CN
InChI
InChI=1S/C6H7N3S/c7-3-5-4-9-1-2-10-6(9)8-5/h1-2,4H,3,7H2
InChIKey
DHSVDAKPQOFXKO-UHFFFAOYSA-N
Compound name
imidazo[2,1-b][1,3]thiazol-6-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

153.03607 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.04335 126.6
[M+Na]+ 176.02529 138.8
[M-H]- 152.02879 129.8
[M+NH4]+ 171.06989 150.5
[M+K]+ 191.99923 136.3
[M+H-H2O]+ 136.03333 121.0
[M+HCOO]- 198.03427 148.0
[M+CH3COO]- 212.04992 141.8
[M+Na-2H]- 174.01074 130.8
[M]+ 153.03552 129.8
[M]- 153.03662 129.8
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

patents stripe