CID 3042316

59512-21-9

Structural Information

Molecular Formula
C18H19NO2
SMILES
CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)N(C)C
InChI
InChI=1S/C18H19NO2/c1-13(18(21)19(2)3)15-10-7-11-16(12-15)17(20)14-8-5-4-6-9-14/h4-13H,1-3H3
InChIKey
ICEJJANOGABWPA-UHFFFAOYSA-N
Compound name
2-(3-benzoylphenyl)-N,N-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.14157 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.148846 166.6
[M+Na]+ 304.130788 171.3
[M-H]- 280.134294 174.3
[M+NH4]+ 299.175393 182.2
[M+K]+ 320.104728 169.4
[M+H-H2O]+ 264.138830 158.3
[M+HCOO]- 326.139771 189.0
[M+CH3COO]- 340.155421 207.8
[M+Na-2H]- 302.116236 167.8
[M]+ 281.14102142 167.5
[M]- 281.14211858 167.5
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.