CID 3039789

Brn 2882949

Structural Information

Molecular Formula

C₁₉H₂₉N₃O

SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(CN(C)CC=C)N(C)CC=C

InChI

InChI=1S/C19H29N3O/c1-7-12-21(5)14-17(22(6)13-8-2)19(23)20-18-15(3)10-9-11-16(18)4/h7-11,17H,1-2,12-14H2,3-6H3,(H,20,23)

InChIKey

UFASHKQOHOLXIE-UHFFFAOYSA-N

Compound name

N-(2,6-dimethylphenyl)-2,3-bis[methyl(prop-2-enyl)amino]propanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 315.23105 Da
Monoisotopic Mass: 3.3
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]+	316.238326	182.2
[M+Na]+	338.220268	185.3
[M-H]-	314.223774	187.6
[M+NH4]+	333.264873	197.2
[M+K]+	354.194208	183.6
[M+H-H2O]+	298.228310	173.7
[M+HCOO]-	360.229251	206.2
[M+CH3COO]-	374.244901	226.0
[M+Na-2H]-	336.205716	180.5
[M]+	315.23050142	184.7
[M]-	315.23159858	184.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.