CID 28373979

1152842-13-1

Structural Information

Molecular Formula

C₁₁H₁₁N₅

SMILES

C1=CC2=NC(=CN2C=C1)CN3C=C(C=N3)N

InChI

InChI=1S/C11H11N5/c12-9-5-13-16(6-9)8-10-7-15-4-2-1-3-11(15)14-10/h1-7H,8,12H2

InChIKey

BTIHVTVZWXPXBM-UHFFFAOYSA-N

Compound name

1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrazol-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 213.10144 Da
Monoisotopic Mass: 1.0
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]+	214.10872	144.0
[M+Na]+	236.09066	155.3
[M-H]-	212.09416	147.4
[M+NH4]+	231.13526	161.6
[M+K]+	252.06460	150.8
[M+H-H2O]+	196.09870	134.7
[M+HCOO]-	258.09964	167.4
[M+CH3COO]-	272.11529	157.2
[M+Na-2H]-	234.07611	150.1
[M]+	213.10089	145.3
[M]-	213.10199	145.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe