CID 3042316

2-(3-benzoylphenyl)-n,n-dimethylpropionamide

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]+ 282.14885 166.6
[M+Na]+ 304.13079 171.3
[M-H]- 280.13429 174.3
[M+NH4]+ 299.17539 182.2
[M+K]+ 320.10473 169.4
[M+H-H2O]+ 264.13883 158.3
[M+HCOO]- 326.13977 189.0
[M+CH3COO]- 340.15542 207.8
[M+Na-2H]- 302.11624 167.8
[M]+ 281.14102 167.5
[M]- 281.14212 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.