CID 24068

Acetanilide, 4'-(1-allyl-1-carbamoyl-3-butenyl)-

Structural Information

Molecular Formula
C16H20N2O2
SMILES
CC(=O)NC1=CC=C(C=C1)C(CC=C)(CC=C)C(=O)N
InChI
InChI=1S/C16H20N2O2/c1-4-10-16(11-5-2,15(17)20)13-6-8-14(9-7-13)18-12(3)19/h4-9H,1-2,10-11H2,3H3,(H2,17,20)(H,18,19)
InChIKey
XVAKJVBWXSZTGC-UHFFFAOYSA-N
Compound name
2-(4-acetamidophenyl)-2-prop-2-enylpent-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.15247 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.15975 166.6
[M+Na]+ 295.14169 174.8
[M+NH4]+ 290.18629 171.7
[M+K]+ 311.11563 169.9
[M-H]- 271.14519 167.0
[M+Na-2H]- 293.12714 170.0
[M]+ 272.15192 167.4
[M]- 272.15302 167.4
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.