CID 3033178

Cinnamamide, n-allyl-4-bromo-alpha,beta-dimethyl-, (e)-

Structural Information

Molecular Formula
C14H16BrNO
SMILES
C/C(=C(/C)\C(=O)NCC=C)/C1=CC=C(C=C1)Br
InChI
InChI=1S/C14H16BrNO/c1-4-9-16-14(17)11(3)10(2)12-5-7-13(15)8-6-12/h4-8H,1,9H2,2-3H3,(H,16,17)/b11-10+
InChIKey
BYGZBJDMQOOULC-ZHACJKMWSA-N
Compound name
(E)-3-(4-bromophenyl)-2-methyl-N-prop-2-enylbut-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

293.04153 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.04881 157.6
[M+Na]+ 316.03075 159.1
[M+NH4]+ 311.07535 161.2
[M+K]+ 332.00469 159.2
[M-H]- 292.03425 157.7
[M+Na-2H]- 314.01620 159.6
[M]+ 293.04098 156.4
[M]- 293.04208 156.4
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.