CID 125514621

Ethyl 3-formyl-1h-pyrrolo[3,2-b]pyridine-6-carboxylate

Structural Information

Molecular Formula
C11H10N2O3
SMILES
CCOC(=O)C1=CC2=C(C(=CN2)C=O)N=C1
InChI
InChI=1S/C11H10N2O3/c1-2-16-11(15)7-3-9-10(13-4-7)8(6-14)5-12-9/h3-6,12H,2H2,1H3
InChIKey
RHUXYEOATGCHDV-UHFFFAOYSA-N
Compound name
ethyl 3-formyl-1H-pyrrolo[3,2-b]pyridine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.06914 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07642 146.1
[M+Na]+ 241.05836 158.6
[M+NH4]+ 236.10296 152.6
[M+K]+ 257.03230 155.0
[M-H]- 217.06186 145.5
[M+Na-2H]- 239.04381 150.8
[M]+ 218.06859 147.4
[M]- 218.06969 147.4
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.