CID 6481536

2-amino-5-chloro-n-(4-fluorophenyl)benzamide

Structural Information

Molecular Formula
C13H10ClFN2O
SMILES
C1=CC(=CC=C1NC(=O)C2=C(C=CC(=C2)Cl)N)F
InChI
InChI=1S/C13H10ClFN2O/c14-8-1-6-12(16)11(7-8)13(18)17-10-4-2-9(15)3-5-10/h1-7H,16H2,(H,17,18)
InChIKey
CMRBWIXHMCNIQT-UHFFFAOYSA-N
Compound name
2-amino-5-chloro-N-(4-fluorophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.04657 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.05385 156.0
[M+Na]+ 287.03579 165.1
[M-H]- 263.03929 161.4
[M+NH4]+ 282.08039 172.8
[M+K]+ 303.00973 159.1
[M+H-H2O]+ 247.04383 148.6
[M+HCOO]- 309.04477 176.0
[M+CH3COO]- 323.06042 199.6
[M+Na-2H]- 285.02124 159.7
[M]+ 264.04602 154.8
[M]- 264.04712 154.8
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.