CID 493520

7-methyl-3-(1,3-dioxolan-2-yl)imidazo[1,2-a]pyridine

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂

SMILES

CC1=CC2=NC=C(N2C=C1)C3OCCO3

InChI

InChI=1S/C11H12N2O2/c1-8-2-3-13-9(7-12-10(13)6-8)11-14-4-5-15-11/h2-3,6-7,11H,4-5H2,1H3

InChIKey

VGRQRGJTTIRXSH-UHFFFAOYSA-N

Compound name

3-(1,3-dioxolan-2-yl)-7-methylimidazo[1,2-a]pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 204.08987 Da
Monoisotopic Mass: 1.6
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]+	205.097146	140.6
[M+Na]+	227.079088	150.9
[M-H]-	203.082594	147.6
[M+NH4]+	222.123693	159.1
[M+K]+	243.053028	150.4
[M+H-H2O]+	187.087130	134.1
[M+HCOO]-	249.088071	161.9
[M+CH3COO]-	263.103721	155.0
[M+Na-2H]-	225.064536	146.3
[M]+	204.08932142	143.6
[M]-	204.09041858	143.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.