CID 22478294

4-(3-hydroxypropyl)-2,6-dimethylmorpholine

Structural Information

Molecular Formula

C₉H₁₉NO₂

SMILES

CC1CN(CC(O1)C)CCCO

InChI

InChI=1S/C9H19NO2/c1-8-6-10(4-3-5-11)7-9(2)12-8/h8-9,11H,3-7H2,1-2H3

InChIKey

QPWCCVFFSASLDL-UHFFFAOYSA-N

Compound name

3-(2,6-dimethylmorpholin-4-yl)propan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 173.14159 Da
Monoisotopic Mass: 0.4
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]+	174.14887	140.8
[M+Na]+	196.13081	146.6
[M-H]-	172.13431	141.7
[M+NH4]+	191.17541	158.2
[M+K]+	212.10475	146.4
[M+H-H2O]+	156.13885	134.7
[M+HCOO]-	218.13979	157.7
[M+CH3COO]-	232.15544	178.7
[M+Na-2H]-	194.11626	145.0
[M]+	173.14104	139.4
[M]-	173.14214	139.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe