CID 39360

42973-07-9

Structural Information

Molecular Formula
C20H32N2O2
SMILES
CCN(CC)CCNC(=O)COC1=CC=C(C=C1)C2CCCCC2
InChI
InChI=1S/C20H32N2O2/c1-3-22(4-2)15-14-21-20(23)16-24-19-12-10-18(11-13-19)17-8-6-5-7-9-17/h10-13,17H,3-9,14-16H2,1-2H3,(H,21,23)
InChIKey
MFLHBPGLWSOMTJ-UHFFFAOYSA-N
Compound name
2-(4-cyclohexylphenoxy)-N-[2-(diethylamino)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.24637 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.253646 184.2
[M+Na]+ 355.235588 184.2
[M-H]- 331.239094 189.8
[M+NH4]+ 350.280193 197.2
[M+K]+ 371.209528 182.0
[M+H-H2O]+ 315.243630 174.7
[M+HCOO]- 377.244571 204.3
[M+CH3COO]- 391.260221 218.9
[M+Na-2H]- 353.221036 184.1
[M]+ 332.24582142 182.6
[M]- 332.24691858 182.6
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.