CID 39197006

{2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl}methanamine dihydrochloride

Structural Information

Molecular Formula
C8H11N3S
SMILES
CC1=CN2C(=C(N=C2S1)C)CN
InChI
InChI=1S/C8H11N3S/c1-5-4-11-7(3-9)6(2)10-8(11)12-5/h4H,3,9H2,1-2H3
InChIKey
JJWLOFYIAILHBZ-UHFFFAOYSA-N
Compound name
(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.06737 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.07465 136.2
[M+Na]+ 204.05659 149.2
[M-H]- 180.06009 139.7
[M+NH4]+ 199.10119 159.5
[M+K]+ 220.03053 145.9
[M+H-H2O]+ 164.06463 130.8
[M+HCOO]- 226.06557 156.8
[M+CH3COO]- 240.08122 151.1
[M+Na-2H]- 202.04204 138.0
[M]+ 181.06682 140.8
[M]- 181.06792 140.8
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

No patent data available for this compound.