CID 25170

N-(2-morpholinoethyl)-beta-tetrahydrofurfuryl-1-naphthalenepropylamine bioxalate

Structural Information

Molecular Formula

C₂₄H₃₄N₂O₂

SMILES

C1CC(OC1)CC(CC2=CC=CC3=CC=CC=C32)CNCCN4CCOCC4

InChI

InChI=1S/C24H34N2O2/c1-2-9-24-21(5-1)6-3-7-22(24)17-20(18-23-8-4-14-28-23)19-25-10-11-26-12-15-27-16-13-26/h1-3,5-7,9,20,23,25H,4,8,10-19H2

InChIKey

FWQWPJCMJGKRCQ-UHFFFAOYSA-N

Compound name

N-(2-morpholin-4-ylethyl)-2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 382.26202 Da
Monoisotopic Mass: 3.7
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]+	383.269296	194.9
[M+Na]+	405.251238	194.3
[M-H]-	381.254744	202.2
[M+NH4]+	400.295843	203.5
[M+K]+	421.225178	191.3
[M+H-H2O]+	365.259280	184.3
[M+HCOO]-	427.260221	207.6
[M+CH3COO]-	441.275871	201.5
[M+Na-2H]-	403.236686	194.8
[M]+	382.26147142	190.5
[M]-	382.26256858	190.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.