CID 202615

1h-indeno(2,1-b)pyridine, 1-methyl-

Structural Information

Molecular Formula

C₁₃H₁₁N

SMILES

CN1C=CC=C2C1=CC3=CC=CC=C32

InChI

InChI=1S/C13H11N/c1-14-8-4-7-12-11-6-3-2-5-10(11)9-13(12)14/h2-9H,1H3

InChIKey

PKANWYWGBFEEOC-UHFFFAOYSA-N

Compound name

1-methylindeno[2,1-b]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 181.08914 Da
Monoisotopic Mass: 2.9
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]+	182.09642	136.3
[M+Na]+	204.07836	147.9
[M-H]-	180.08186	141.4
[M+NH4]+	199.12296	159.5
[M+K]+	220.05230	143.1
[M+H-H2O]+	164.08640	129.9
[M+HCOO]-	226.08734	160.3
[M+CH3COO]-	240.10299	151.2
[M+Na-2H]-	202.06381	145.5
[M]+	181.08859	138.7
[M]-	181.08969	138.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.