CID 53421081

1628617-14-0

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

C1COCC(N1)CCO

InChI

InChI=1S/C6H13NO2/c8-3-1-6-5-9-4-2-7-6/h6-8H,1-5H2

InChIKey

TVPDWWYLCZDJKD-UHFFFAOYSA-N

Compound name

2-morpholin-3-ylethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 121
Patents: 131.09464 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]+	132.10192	128.2
[M+Na]+	154.08386	132.9
[M-H]-	130.08736	127.4
[M+NH4]+	149.12846	145.8
[M+K]+	170.05780	132.4
[M+H-H2O]+	114.09190	122.2
[M+HCOO]-	176.09284	144.6
[M+CH3COO]-	190.10849	164.7
[M+Na-2H]-	152.06931	134.9
[M]+	131.09409	122.9
[M]-	131.09519	122.9

Literature stripe

literature stripe

Patent stripe

patents stripe