CID 28233

A 1215

Structural Information

Molecular Formula

C₂₃H₃₂N₂O₂

SMILES

CCCN(CCC)CC(=O)NC1=C(C=C(C=C1C)OCC2=CC=CC=C2)C

InChI

InChI=1S/C23H32N2O2/c1-5-12-25(13-6-2)16-22(26)24-23-18(3)14-21(15-19(23)4)27-17-20-10-8-7-9-11-20/h7-11,14-15H,5-6,12-13,16-17H2,1-4H3,(H,24,26)

InChIKey

SNTDPSZKPUYZOP-UHFFFAOYSA-N

Compound name

N-(2,6-dimethyl-4-phenylmethoxyphenyl)-2-(dipropylamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 368.24637 Da
Monoisotopic Mass: 5.1
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]+	369.253646	195.0
[M+Na]+	391.235588	198.6
[M-H]-	367.239094	202.0
[M+NH4]+	386.280193	207.4
[M+K]+	407.209528	195.2
[M+H-H2O]+	351.243630	185.1
[M+HCOO]-	413.244571	218.3
[M+CH3COO]-	427.260221	229.1
[M+Na-2H]-	389.221036	194.7
[M]+	368.24582142	199.5
[M]-	368.24691858	199.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe