CID 98999

63295-51-2

Structural Information

Molecular Formula

C₉H₁₉NO₂

SMILES

CC1CN(CC(O1)C)CC(C)O

InChI

InChI=1S/C9H19NO2/c1-7(11)4-10-5-8(2)12-9(3)6-10/h7-9,11H,4-6H2,1-3H3

InChIKey

VTTSSRXYYVVNLI-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 173.14159 Da
Monoisotopic Mass: 0.5
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]+	174.148866	141.0
[M+Na]+	196.130808	146.6
[M-H]-	172.134314	142.0
[M+NH4]+	191.175413	158.3
[M+K]+	212.104748	146.8
[M+H-H2O]+	156.138850	135.0
[M+HCOO]-	218.139791	156.9
[M+CH3COO]-	232.155441	179.6
[M+Na-2H]-	194.116256	144.0
[M]+	173.14104142	138.9
[M]-	173.14213858	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe