CID 58024782

2-(chloromethyl)-7-(trifluoromethyl)imidazo[1,2-a]pyridine hydrochloride

Structural Information

Molecular Formula
C9H6ClF3N2
SMILES
C1=CN2C=C(N=C2C=C1C(F)(F)F)CCl
InChI
InChI=1S/C9H6ClF3N2/c10-4-7-5-15-2-1-6(9(11,12)13)3-8(15)14-7/h1-3,5H,4H2
InChIKey
XLQLGNBGVKYTLV-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-7-(trifluoromethyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

234.01717 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.02445 142.4
[M+Na]+ 257.00639 155.6
[M-H]- 233.00989 141.2
[M+NH4]+ 252.05099 161.9
[M+K]+ 272.98033 149.8
[M+H-H2O]+ 217.01443 133.7
[M+HCOO]- 279.01537 157.0
[M+CH3COO]- 293.03102 187.8
[M+Na-2H]- 254.99184 149.1
[M]+ 234.01662 143.1
[M]- 234.01772 143.1
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

patents stripe