CID 3033126

Cinnamamide, n-butyl-alpha,beta-dimethyl-, (z)-

Structural Information

Molecular Formula
C15H21NO
SMILES
CCCCNC(=O)/C(=C(/C)\C1=CC=CC=C1)/C
InChI
InChI=1S/C15H21NO/c1-4-5-11-16-15(17)13(3)12(2)14-9-7-6-8-10-14/h6-10H,4-5,11H2,1-3H3,(H,16,17)/b13-12-
InChIKey
LMOMSYAUAHTACH-SEYXRHQNSA-N
Compound name
(Z)-N-butyl-2-methyl-3-phenylbut-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.16231 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.169586 158.1
[M+Na]+ 254.151528 162.1
[M-H]- 230.155034 160.9
[M+NH4]+ 249.196133 175.6
[M+K]+ 270.125468 159.4
[M+H-H2O]+ 214.159570 151.3
[M+HCOO]- 276.160511 179.4
[M+CH3COO]- 290.176161 195.8
[M+Na-2H]- 252.136976 159.6
[M]+ 231.16176142 157.4
[M]- 231.16285858 157.4
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.