CID 6449395

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

Structural Information

Molecular Formula
C12H13NO2
SMILES
C1=CC=C(C=C1)C(/C=C/C=C/C(=O)N)O
InChI
InChI=1S/C12H13NO2/c13-12(15)9-5-4-8-11(14)10-6-2-1-3-7-10/h1-9,11,14H,(H2,13,15)/b8-4+,9-5+
InChIKey
URLWEJZUYQZEJB-KBXRYBNXSA-N
Compound name
(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.09464 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.101916 146.9
[M+Na]+ 226.083858 152.2
[M-H]- 202.087364 148.2
[M+NH4]+ 221.128463 164.3
[M+K]+ 242.057798 148.4
[M+H-H2O]+ 186.091900 140.6
[M+HCOO]- 248.092841 168.4
[M+CH3COO]- 262.108491 183.8
[M+Na-2H]- 224.069306 149.6
[M]+ 203.09409142 143.5
[M]- 203.09518858 143.5
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

No patent data available for this compound.