CID 64174743

[3-(morpholin-4-yl)oxan-3-yl]methanamine

Structural Information

Molecular Formula

C₁₀H₂₀N₂O₂

SMILES

C1CC(COC1)(CN)N2CCOCC2

InChI

InChI=1S/C10H20N2O2/c11-8-10(2-1-5-14-9-10)12-3-6-13-7-4-12/h1-9,11H2

InChIKey

JOUAIBFJKJTHPM-UHFFFAOYSA-N

Compound name

(3-morpholin-4-yloxan-3-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 200.15248 Da
Monoisotopic Mass: -0.8
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]+	201.159756	147.4
[M+Na]+	223.141698	149.7
[M-H]-	199.145204	151.7
[M+NH4]+	218.186303	163.0
[M+K]+	239.115638	150.7
[M+H-H2O]+	183.149740	139.6
[M+HCOO]-	245.150681	162.0
[M+CH3COO]-	259.166331	182.9
[M+Na-2H]-	221.127146	153.4
[M]+	200.15193142	139.7
[M]-	200.15302858	139.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe