CID 53395302

Dtxsid101168373

Structural Information

Molecular Formula

C₁₅H₂₀N₂O₂

SMILES

CCN(C1=CC=CC(=C1)C(=O)C=CN(C)C)C(=O)C

InChI

InChI=1S/C15H20N2O2/c1-5-17(12(2)18)14-8-6-7-13(11-14)15(19)9-10-16(3)4/h6-11H,5H2,1-4H3

InChIKey

UXWJJVRASIHSQS-UHFFFAOYSA-N

Compound name

N-[3-[3-(dimethylamino)prop-2-enoyl]phenyl]-N-ethylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 83
Patents: 260.15247 Da
Monoisotopic Mass: 1.7
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]+	261.159746	162.7
[M+Na]+	283.141688	167.5
[M-H]-	259.145194	168.7
[M+NH4]+	278.186293	180.1
[M+K]+	299.115628	167.2
[M+H-H2O]+	243.149730	155.1
[M+HCOO]-	305.150671	187.4
[M+CH3COO]-	319.166321	209.2
[M+Na-2H]-	281.127136	163.7
[M]+	260.15192142	165.6
[M]-	260.15301858	165.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe