CID 3072215

Acetamide, 2-chloro-2,2-difluoro-n-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-

Structural Information

Molecular Formula
C9H7ClF5N3O3S
SMILES
CS(=O)(=O)NC1=C(C=C(C=N1)C(F)(F)F)NC(=O)C(F)(F)Cl
InChI
InChI=1S/C9H7ClF5N3O3S/c1-22(20,21)18-6-5(17-7(19)8(10,11)12)2-4(3-16-6)9(13,14)15/h2-3H,1H3,(H,16,18)(H,17,19)
InChIKey
YUXIBNOHDCKQKJ-UHFFFAOYSA-N
Compound name
2-chloro-2,2-difluoro-N-[2-(methanesulfonamido)-5-(trifluoromethyl)pyridin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.9817 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.98898 173.7
[M+Na]+ 389.97092 176.8
[M+NH4]+ 385.01552 174.4
[M+K]+ 405.94486 174.0
[M-H]- 365.97442 165.9
[M+Na-2H]- 387.95637 173.6
[M]+ 366.98115 171.8
[M]- 366.98225 171.8
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.