CID 29032

18341-14-5

Structural Information

Molecular Formula

C₁₉H₂₃NO₄

SMILES

CC(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C19H23NO4/c1-13(10-14-8-6-5-7-9-14)20-19(21)15-11-16(22-2)18(24-4)17(12-15)23-3/h5-9,11-13H,10H2,1-4H3,(H,20,21)

InChIKey

IZVWGCYQLXQLMK-UHFFFAOYSA-N

Compound name

3,4,5-trimethoxy-N-(1-phenylpropan-2-yl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 329.16272 Da
Monoisotopic Mass: 3.5
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]+	330.169996	178.5
[M+Na]+	352.151938	184.2
[M-H]-	328.155444	185.2
[M+NH4]+	347.196543	192.1
[M+K]+	368.125878	182.2
[M+H-H2O]+	312.159980	169.8
[M+HCOO]-	374.160921	201.2
[M+CH3COO]-	388.176571	213.9
[M+Na-2H]-	350.137386	179.8
[M]+	329.16217142	183.5
[M]-	329.16326858	183.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe