CID 668760

4-chloro-n-ethyl-n-phenylbenzamide

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.0764 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.08368 157.7
[M+Na]+ 282.06562 165.0
[M-H]- 258.06912 165.5
[M+NH4]+ 277.11022 175.4
[M+K]+ 298.03956 160.7
[M+H-H2O]+ 242.07366 150.6
[M+HCOO]- 304.07460 178.1
[M+CH3COO]- 318.09025 199.5
[M+Na-2H]- 280.05107 162.4
[M]+ 259.07585 160.4
[M]- 259.07695 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.