CID 4530054

N-(3,5-dichlorophenyl)-1-naphthamide

Structural Information

Molecular Formula
C17H11Cl2NO
SMILES
C1=CC=C2C(=C1)C=CC=C2C(=O)NC3=CC(=CC(=C3)Cl)Cl
InChI
InChI=1S/C17H11Cl2NO/c18-12-8-13(19)10-14(9-12)20-17(21)16-7-3-5-11-4-1-2-6-15(11)16/h1-10H,(H,20,21)
InChIKey
PEPJFRYGLSGITB-UHFFFAOYSA-N
Compound name
N-(3,5-dichlorophenyl)naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

315.02176 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.029036 168.1
[M+Na]+ 338.010978 178.0
[M-H]- 314.014484 175.0
[M+NH4]+ 333.055583 184.7
[M+K]+ 353.984918 170.4
[M+H-H2O]+ 298.019020 161.7
[M+HCOO]- 360.019961 182.0
[M+CH3COO]- 374.035611 179.8
[M+Na-2H]- 335.996426 173.4
[M]+ 315.02121142 171.4
[M]- 315.02230858 171.4
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

patents stripe