CID 1527154

N-methyl-m-(trifluoromethyl)cinnamamide

Structural Information

Molecular Formula

C₁₁H₁₀F₃NO

SMILES

CNC(=O)/C=C/C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C11H10F3NO/c1-15-10(16)6-5-8-3-2-4-9(7-8)11(12,13)14/h2-7H,1H3,(H,15,16)/b6-5+

InChIKey

YEBIYCKHVHLBHN-AATRIKPKSA-N

Compound name

(E)-N-methyl-3-[3-(trifluoromethyl)phenyl]prop-2-enamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 14
Patents: 229.07144 Da
Monoisotopic Mass: 2.5
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]+	230.07872	152.7
[M+Na]+	252.06066	160.8
[M+NH4]+	247.10526	157.6
[M+K]+	268.03460	155.4
[M-H]-	228.06416	149.6
[M+Na-2H]-	250.04611	156.2
[M]+	229.07089	152.5
[M]-	229.07199	152.5

Literature stripe

literature stripe

Patent stripe

patents stripe