CID 722355

2-chloro-n-ethyl-n-phenylbenzamide

Structural Information

Molecular Formula
C15H14ClNO
SMILES
CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C15H14ClNO/c1-2-17(12-8-4-3-5-9-12)15(18)13-10-6-7-11-14(13)16/h3-11H,2H2,1H3
InChIKey
CLYJUAKTPOEIAZ-UHFFFAOYSA-N
Compound name
2-chloro-N-ethyl-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

5
Patents

259.0764 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.083676 157.7
[M+Na]+ 282.065618 165.0
[M-H]- 258.069124 165.5
[M+NH4]+ 277.110223 175.4
[M+K]+ 298.039558 160.7
[M+H-H2O]+ 242.073660 150.6
[M+HCOO]- 304.074601 178.1
[M+CH3COO]- 318.090251 199.5
[M+Na-2H]- 280.051066 162.4
[M]+ 259.07585142 160.4
[M]- 259.07694858 160.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe