CID 6449394

2,4-hexadienamide, 6-phenyl-, (e,e)-

Structural Information

Molecular Formula
C12H13NO
SMILES
C1=CC=C(C=C1)C/C=C/C=C/C(=O)N
InChI
InChI=1S/C12H13NO/c13-12(14)10-6-2-5-9-11-7-3-1-4-8-11/h1-8,10H,9H2,(H2,13,14)/b5-2+,10-6+
InChIKey
ZLGUPZHJSPVACC-SUWMZURFSA-N
Compound name
(2E,4E)-6-phenylhexa-2,4-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.09972 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.106996 142.7
[M+Na]+ 210.088938 148.8
[M-H]- 186.092444 145.3
[M+NH4]+ 205.133543 161.7
[M+K]+ 226.062878 144.8
[M+H-H2O]+ 170.096980 136.4
[M+HCOO]- 232.097921 166.5
[M+CH3COO]- 246.113571 183.4
[M+Na-2H]- 208.074386 147.3
[M]+ 187.09917142 140.5
[M]- 187.10026858 140.5
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

patents stripe