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]+ 260.08368 157.9
[M+Na]+ 282.06562 173.1
[M+NH4]+ 277.11022 167.5
[M+K]+ 298.03956 164.4
[M-H]- 258.06912 163.7
[M+Na-2H]- 280.05107 168.2
[M]+ 259.07585 162.1
[M]- 259.07695 162.1
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