CID 6449390

2,4-hexadienamide, 6-(4-hydroxyphenyl)-n-(2-methylpropyl)-, (e,e)-

Structural Information

Molecular Formula
C16H21NO2
SMILES
CC(C)CNC(=O)/C=C/C=C/CC1=CC=C(C=C1)O
InChI
InChI=1S/C16H21NO2/c1-13(2)12-17-16(19)7-5-3-4-6-14-8-10-15(18)11-9-14/h3-5,7-11,13,18H,6,12H2,1-2H3,(H,17,19)/b4-3+,7-5+
InChIKey
GQCPXSPJJBYXGG-BDWKERMESA-N
Compound name
(2E,4E)-6-(4-hydroxyphenyl)-N-(2-methylpropyl)hexa-2,4-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.15723 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.16451 164.3
[M+Na]+ 282.14645 168.9
[M-H]- 258.14995 165.8
[M+NH4]+ 277.19105 180.2
[M+K]+ 298.12039 164.5
[M+H-H2O]+ 242.15449 157.6
[M+HCOO]- 304.15543 185.1
[M+CH3COO]- 318.17108 197.1
[M+Na-2H]- 280.13190 165.3
[M]+ 259.15668 163.7
[M]- 259.15778 163.7
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.