CID 513621

Peec^3a

Structural Information

Molecular Formula
C10H15N4O4P
SMILES
C1=CN=C(C2=C1N(C=N2)CCOCCP(=O)(O)O)N
InChI
InChI=1S/C10H15N4O4P/c11-10-9-8(1-2-12-10)14(7-13-9)3-4-18-5-6-19(15,16)17/h1-2,7H,3-6H2,(H2,11,12)(H2,15,16,17)
InChIKey
XXWBQZLAJJBBQB-UHFFFAOYSA-N
Compound name
2-[2-(4-aminoimidazo[4,5-c]pyridin-1-yl)ethoxy]ethylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.0831 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.09038 163.4
[M+Na]+ 309.07232 171.5
[M-H]- 285.07582 160.4
[M+NH4]+ 304.11692 176.5
[M+K]+ 325.04626 168.7
[M+H-H2O]+ 269.08036 153.3
[M+HCOO]- 331.08130 187.2
[M+CH3COO]- 345.09695 196.5
[M+Na-2H]- 307.05777 166.9
[M]+ 286.08255 166.5
[M]- 286.08365 166.5
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.