CID 6447983

108331-88-0

Structural Information

Molecular Formula
C16H19NO2
SMILES
CC(C)CNC(=O)/C=C/C=C/C(=O)C1=CC=CC=C1
InChI
InChI=1S/C16H19NO2/c1-13(2)12-17-16(19)11-7-6-10-15(18)14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,17,19)/b10-6+,11-7+
InChIKey
GMAIUKVGNZXDPW-JMQWPVDRSA-N
Compound name
(2E,4E)-N-(2-methylpropyl)-6-oxo-6-phenylhexa-2,4-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.14157 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.14885 163.7
[M+Na]+ 280.13079 173.2
[M+NH4]+ 275.17539 169.6
[M+K]+ 296.10473 166.9
[M-H]- 256.13429 164.4
[M+Na-2H]- 278.11624 167.8
[M]+ 257.14102 164.8
[M]- 257.14212 164.8
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.