CID 12222773

Imidazo[1,5-a]pyridine-1-carbaldehyde

Structural Information

Molecular Formula
C8H6N2O
SMILES
C1=CC2=C(N=CN2C=C1)C=O
InChI
InChI=1S/C8H6N2O/c11-5-7-8-3-1-2-4-10(8)6-9-7/h1-6H
InChIKey
FBNBTPDUMOHHFF-UHFFFAOYSA-N
Compound name
imidazo[1,5-a]pyridine-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

146.04802 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.05530 124.9
[M+Na]+ 169.03724 136.5
[M-H]- 145.04074 127.7
[M+NH4]+ 164.08184 146.8
[M+K]+ 185.01118 133.8
[M+H-H2O]+ 129.04528 118.2
[M+HCOO]- 191.04622 149.8
[M+CH3COO]- 205.06187 140.2
[M+Na-2H]- 167.02269 134.6
[M]+ 146.04747 127.7
[M]- 146.04857 127.7
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

patents stripe