CID 202102

2-allyl-2-(p-(dimethylamino)phenyl)-4-pentenamide hydrochloride

Structural Information

Molecular Formula
C16H22N2O
SMILES
CN(C)C1=CC=C(C=C1)C(CC=C)(CC=C)C(=O)N
InChI
InChI=1S/C16H22N2O/c1-5-11-16(12-6-2,15(17)19)13-7-9-14(10-8-13)18(3)4/h5-10H,1-2,11-12H2,3-4H3,(H2,17,19)
InChIKey
HLJVPVSSSDBPFE-UHFFFAOYSA-N
Compound name
2-[4-(dimethylamino)phenyl]-2-prop-2-enylpent-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.17322 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.18050 164.4
[M+Na]+ 281.16244 173.6
[M+NH4]+ 276.20704 170.7
[M+K]+ 297.13638 167.9
[M-H]- 257.16594 166.1
[M+Na-2H]- 279.14789 169.0
[M]+ 258.17267 165.9
[M]- 258.17377 165.9
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.