CID 6449395

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

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]+ 204.10192 146.9
[M+Na]+ 226.08386 152.2
[M-H]- 202.08736 148.2
[M+NH4]+ 221.12846 164.3
[M+K]+ 242.05780 148.4
[M+H-H2O]+ 186.09190 140.6
[M+HCOO]- 248.09284 168.4
[M+CH3COO]- 262.10849 183.8
[M+Na-2H]- 224.06931 149.6
[M]+ 203.09409 143.5
[M]- 203.09519 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.