CID 4187993

70298-67-8

Structural Information

Molecular Formula
C22H21NO
SMILES
CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C22H21NO/c1-16-13-14-17(2)20(15-16)23-22(24)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-15,21H,1-2H3,(H,23,24)
InChIKey
XWYZWENRGSOHMY-UHFFFAOYSA-N
Compound name
N-(2,5-dimethylphenyl)-2,2-diphenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.16232 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.169596 177.0
[M+Na]+ 338.151538 182.1
[M-H]- 314.155044 186.3
[M+NH4]+ 333.196143 190.4
[M+K]+ 354.125478 176.7
[M+H-H2O]+ 298.159580 167.5
[M+HCOO]- 360.160521 199.3
[M+CH3COO]- 374.176171 211.4
[M+Na-2H]- 336.136986 179.7
[M]+ 315.16177142 175.6
[M]- 315.16286858 175.6
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.