CID 119443353

1829802-92-7

Structural Information

Molecular Formula
C13H15ClF2N2O
SMILES
CN(C1CCNCC1)C(=O)C2=CC(=C(C=C2Cl)F)F
InChI
InChI=1S/C13H15ClF2N2O/c1-18(8-2-4-17-5-3-8)13(19)9-6-11(15)12(16)7-10(9)14/h6-8,17H,2-5H2,1H3
InChIKey
XQMJYZJPTRHJGD-UHFFFAOYSA-N
Compound name
2-chloro-4,5-difluoro-N-methyl-N-piperidin-4-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.0841 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.09138 161.9
[M+Na]+ 311.07332 168.4
[M-H]- 287.07682 164.0
[M+NH4]+ 306.11792 176.6
[M+K]+ 327.04726 163.4
[M+H-H2O]+ 271.08136 152.9
[M+HCOO]- 333.08230 173.7
[M+CH3COO]- 347.09795 202.4
[M+Na-2H]- 309.05877 161.7
[M]+ 288.08355 156.8
[M]- 288.08465 156.8
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.