CID 3046030

61458-32-0

Structural Information

Molecular Formula
C22H28N2O2
SMILES
CC1=C(C=CC(=C1)OCC2=CC=CC=C2)NC(=O)CNC3CCCCC3
InChI
InChI=1S/C22H28N2O2/c1-17-14-20(26-16-18-8-4-2-5-9-18)12-13-21(17)24-22(25)15-23-19-10-6-3-7-11-19/h2,4-5,8-9,12-14,19,23H,3,6-7,10-11,15-16H2,1H3,(H,24,25)
InChIKey
ZEGUFNJKJIUKHV-UHFFFAOYSA-N
Compound name
2-(cyclohexylamino)-N-(2-methyl-4-phenylmethoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.2151 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.222376 185.5
[M+Na]+ 375.204318 186.7
[M-H]- 351.207824 193.3
[M+NH4]+ 370.248923 196.8
[M+K]+ 391.178258 182.1
[M+H-H2O]+ 335.212360 175.2
[M+HCOO]- 397.213301 205.7
[M+CH3COO]- 411.228951 218.7
[M+Na-2H]- 373.189766 187.1
[M]+ 352.21455142 181.1
[M]- 352.21564858 181.1
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.