CID 3042563

R 731

Structural Information

Molecular Formula

C₂₃H₃₂N₂O

SMILES

CCCCN(CCCC)CC(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C23H32N2O/c1-3-5-17-25(18-6-4-2)19-22(26)24-23(20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,23H,3-6,17-19H2,1-2H3,(H,24,26)

InChIKey

LADNDHYHHOWENI-UHFFFAOYSA-N

Compound name

N-benzhydryl-2-(dibutylamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 352.25146 Da
Monoisotopic Mass: 5.3
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]+	353.258736	192.2
[M+Na]+	375.240678	192.9
[M-H]-	351.244184	198.1
[M+NH4]+	370.285283	204.3
[M+K]+	391.214618	189.1
[M+H-H2O]+	335.248720	182.1
[M+HCOO]-	397.249661	214.4
[M+CH3COO]-	411.265311	224.3
[M+Na-2H]-	373.226126	192.9
[M]+	352.25091142	193.5
[M]-	352.25200858	193.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.