CID 13259011

Imidazo(1,2-a)pyridine-3-acetamide, 2-(5-chloro-2-thienyl)-n,n,6-trimethyl-

Structural Information

Molecular Formula

C₁₆H₁₆ClN₃OS

SMILES

CC1=CN2C(=NC(=C2CC(=O)N(C)C)C3=CC=C(S3)Cl)C=C1

InChI

InChI=1S/C16H16ClN3OS/c1-10-4-7-14-18-16(12-5-6-13(17)22-12)11(20(14)9-10)8-15(21)19(2)3/h4-7,9H,8H2,1-3H3

InChIKey

ZQIAIUNEBHEWRU-UHFFFAOYSA-N

Compound name

2-[2-(5-chlorothiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 333.07025 Da
Monoisotopic Mass: 2.8
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]+	334.077526	178.2
[M+Na]+	356.059468	190.3
[M-H]-	332.062974	186.6
[M+NH4]+	351.104073	196.8
[M+K]+	372.033408	185.2
[M+H-H2O]+	316.067510	171.5
[M+HCOO]-	378.068451	193.4
[M+CH3COO]-	392.084101	191.0
[M+Na-2H]-	354.044916	176.3
[M]+	333.06970142	187.7
[M]-	333.07079858	187.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.