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]+ 331.23802 184.9
[M+Na]+ 353.21996 187.8
[M-H]- 329.22346 188.0
[M+NH4]+ 348.26456 198.5
[M+K]+ 369.19390 184.5
[M+H-H2O]+ 313.22800 176.9
[M+HCOO]- 375.22894 206.1
[M+CH3COO]- 389.24459 220.9
[M+Na-2H]- 351.20541 185.0
[M]+ 330.23019 187.5
[M]- 330.23129 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.