CID 11586310

2-methyl-1h-pyrrolo[3,2-b]pyridine

Structural Information

Molecular Formula

C₈H₈N₂

SMILES

CC1=CC2=C(N1)C=CC=N2

InChI

InChI=1S/C8H8N2/c1-6-5-8-7(10-6)3-2-4-9-8/h2-5,10H,1H3

InChIKey

FTDBLXOLABKXNQ-UHFFFAOYSA-N

Compound name

2-methyl-1H-pyrrolo[3,2-b]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 226
Patents: 132.06874 Da
Monoisotopic Mass: 1.5
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]+	133.07602	123.7
[M+Na]+	155.05796	138.2
[M+NH4]+	150.10256	133.2
[M+K]+	171.03190	132.9
[M-H]-	131.06146	125.4
[M+Na-2H]-	153.04341	131.6
[M]+	132.06819	126.3
[M]-	132.06929	126.3

Literature stripe

literature stripe

Patent stripe

patents stripe