CID 201129

3323-17-9

Structural Information

Molecular Formula
C16H17N3O2S
SMILES
CN(C)C1=C(N=C2N1C=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C
InChI
InChI=1S/C16H17N3O2S/c1-18(2)16-15(17-14-6-4-5-11-19(14)16)12-7-9-13(10-8-12)22(3,20)21/h4-11H,1-3H3
InChIKey
KCYYVPBPRCBOEZ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.10416 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.11144 171.0
[M+Na]+ 338.09338 185.2
[M+NH4]+ 333.13798 178.8
[M+K]+ 354.06732 178.6
[M-H]- 314.09688 174.7
[M+Na-2H]- 336.07883 179.2
[M]+ 315.10361 174.7
[M]- 315.10471 174.7
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.