CID 3053897

Acetamide, n-(2-benzoyl-4-chlorophenyl)-n-methyl-2-(2-propenylamino)-, monohydrochloride

Structural Information

Molecular Formula
C19H19ClN2O2
SMILES
CN(C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2)C(=O)CNCC=C
InChI
InChI=1S/C19H19ClN2O2/c1-3-11-21-13-18(23)22(2)17-10-9-15(20)12-16(17)19(24)14-7-5-4-6-8-14/h3-10,12,21H,1,11,13H2,2H3
InChIKey
LRPOSRBSFGWBFF-UHFFFAOYSA-N
Compound name
N-(2-benzoyl-4-chlorophenyl)-N-methyl-2-(prop-2-enylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.1135 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.12078 181.5
[M+Na]+ 365.10272 187.2
[M-H]- 341.10622 189.0
[M+NH4]+ 360.14732 195.4
[M+K]+ 381.07666 182.0
[M+H-H2O]+ 325.11076 173.4
[M+HCOO]- 387.11170 201.2
[M+CH3COO]- 401.12735 218.9
[M+Na-2H]- 363.08817 182.5
[M]+ 342.11295 184.7
[M]- 342.11405 184.7
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.