CID 510911

3-[(2,6,7-trichloroimidazo[1,2-a]pyridin-3-yl)methoxy]propane-1,2-diol

Structural Information

Molecular Formula
C11H11Cl3N2O3
SMILES
C1=C(C(=CN2C1=NC(=C2COCC(CO)O)Cl)Cl)Cl
InChI
InChI=1S/C11H11Cl3N2O3/c12-7-1-10-15-11(14)9(16(10)2-8(7)13)5-19-4-6(18)3-17/h1-2,6,17-18H,3-5H2
InChIKey
JIYOJQHBXFMQJL-UHFFFAOYSA-N
Compound name
3-[(2,6,7-trichloroimidazo[1,2-a]pyridin-3-yl)methoxy]propane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

323.98352 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.99080 161.9
[M+Na]+ 346.97274 173.6
[M-H]- 322.97624 160.5
[M+NH4]+ 342.01734 177.0
[M+K]+ 362.94668 167.3
[M+H-H2O]+ 306.98078 157.0
[M+HCOO]- 368.98172 166.6
[M+CH3COO]- 382.99737 199.8
[M+Na-2H]- 344.95819 163.6
[M]+ 323.98297 168.7
[M]- 323.98407 168.7
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.