CID 5877832

N-(3-hydroxypropyl)cinnamamide

Structural Information

Molecular Formula
C12H15NO2
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NCCCO
InChI
InChI=1S/C12H15NO2/c14-10-4-9-13-12(15)8-7-11-5-2-1-3-6-11/h1-3,5-8,14H,4,9-10H2,(H,13,15)/b8-7+
InChIKey
SEVBHPUMAQYJSX-BQYQJAHWSA-N
Compound name
(E)-N-(3-hydroxypropyl)-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

205.11028 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.11756 147.9
[M+Na]+ 228.09950 158.3
[M+NH4]+ 223.14410 155.0
[M+K]+ 244.07344 151.8
[M-H]- 204.10300 149.2
[M+Na-2H]- 226.08495 153.4
[M]+ 205.10973 149.4
[M]- 205.11083 149.4
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