CID 373077

63604-59-1

Structural Information

Molecular Formula

C₇H₇N₃

SMILES

CC1=NC2=C(N1)C=NC=C2

InChI

InChI=1S/C7H7N3/c1-5-9-6-2-3-8-4-7(6)10-5/h2-4H,1H3,(H,9,10)

InChIKey

JWQVOMJORQXNME-UHFFFAOYSA-N

Compound name

2-methyl-3H-imidazo[4,5-c]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 323
Patents: 133.064 Da
Monoisotopic Mass: 0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	134.07128	123.8
[M+Na]+	156.05322	138.2
[M+NH4]+	151.09782	132.5
[M+K]+	172.02716	133.4
[M-H]-	132.05672	124.6
[M+Na-2H]-	154.03867	131.4
[M]+	133.06345	126.0
[M]-	133.06455	126.0

Literature stripe

literature stripe

Patent stripe

patents stripe