CID 487360

Imidazo[1,2-a]pyridine, 2-(2-furanyl)-7-methyl-3-nitroso-

Structural Information

Molecular Formula
C12H9N3O2
SMILES
CC1=CC2=NC(=C(N2C=C1)N=O)C3=CC=CO3
InChI
InChI=1S/C12H9N3O2/c1-8-4-5-15-10(7-8)13-11(12(15)14-16)9-3-2-6-17-9/h2-7H,1H3
InChIKey
NGRGPTJSYIYNJM-UHFFFAOYSA-N
Compound name
2-(furan-2-yl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

227.06947 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.076746 145.3
[M+Na]+ 250.058688 157.6
[M-H]- 226.062194 154.1
[M+NH4]+ 245.103293 164.8
[M+K]+ 266.032628 155.8
[M+H-H2O]+ 210.066730 137.8
[M+HCOO]- 272.067671 172.8
[M+CH3COO]- 286.083321 160.7
[M+Na-2H]- 248.044136 152.3
[M]+ 227.06892142 151.7
[M]- 227.07001858 151.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.