CID 5273477

N,n-bis(2-hydroxyethyl)cinnamamide

Structural Information

Molecular Formula

C₁₃H₁₇NO₃

SMILES

C1=CC=C(C=C1)/C=C/C(=O)N(CCO)CCO

InChI

InChI=1S/C13H17NO3/c15-10-8-14(9-11-16)13(17)7-6-12-4-2-1-3-5-12/h1-7,15-16H,8-11H2/b7-6+

InChIKey

SELFEGODBFAHGT-VOTSOKGWSA-N

Compound name

(E)-N,N-bis(2-hydroxyethyl)-3-phenylprop-2-enamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 15
Patents: 235.12085 Da
Monoisotopic Mass: 0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	236.12813	155.4
[M+Na]+	258.11007	164.7
[M+NH4]+	253.15467	161.6
[M+K]+	274.08401	159.4
[M-H]-	234.11357	155.9
[M+Na-2H]-	256.09552	159.8
[M]+	235.12030	156.4
[M]-	235.12140	156.4

Literature stripe

literature stripe

Patent stripe

patents stripe