CID 202106

4-pentenamide, 2-allyl-2-(p-(2-(diethylamino)ethoxy)phenyl)-

Structural Information

Molecular Formula
C20H30N2O2
SMILES
CCN(CC)CCOC1=CC=C(C=C1)C(CC=C)(CC=C)C(=O)N
InChI
InChI=1S/C20H30N2O2/c1-5-13-20(14-6-2,19(21)23)17-9-11-18(12-10-17)24-16-15-22(7-3)8-4/h5-6,9-12H,1-2,7-8,13-16H2,3-4H3,(H2,21,23)
InChIKey
SNCFCWOIXMOOPX-UHFFFAOYSA-N
Compound name
2-[4-[2-(diethylamino)ethoxy]phenyl]-2-prop-2-enylpent-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.23074 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.238016 184.9
[M+Na]+ 353.219958 187.8
[M-H]- 329.223464 188.0
[M+NH4]+ 348.264563 198.5
[M+K]+ 369.193898 184.5
[M+H-H2O]+ 313.228000 176.9
[M+HCOO]- 375.228941 206.1
[M+CH3COO]- 389.244591 220.9
[M+Na-2H]- 351.205406 185.0
[M]+ 330.23019142 187.5
[M]- 330.23128858 187.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.