CID 3055082

72017-53-9

Structural Information

Molecular Formula
C17H19N3O2S
SMILES
CN(C)CC1=C(N=C2N1C=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C
InChI
InChI=1S/C17H19N3O2S/c1-19(2)12-15-17(18-16-6-4-5-11-20(15)16)13-7-9-14(10-8-13)23(3,21)22/h4-11H,12H2,1-3H3
InChIKey
YXKKGAOLYRQCKH-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-[2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.1198 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.12708 175.4
[M+Na]+ 352.10902 189.4
[M+NH4]+ 347.15362 183.0
[M+K]+ 368.08296 182.5
[M-H]- 328.11252 179.0
[M+Na-2H]- 350.09447 183.3
[M]+ 329.11925 179.0
[M]- 329.12035 179.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.