CID 79606

Morphonol

Structural Information

Molecular Formula

C₈H₁₈NO₃

SMILES

C1COCC[N+]1(CCO)CCO

InChI

InChI=1S/C8H18NO3/c10-5-1-9(2-6-11)3-7-12-8-4-9/h10-11H,1-8H2/q+1

InChIKey

QYCSIFOXRDUBQZ-UHFFFAOYSA-N

Compound name

2-[4-(2-hydroxyethyl)morpholin-4-ium-4-yl]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 176.12866 Da
Monoisotopic Mass: -1.5
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]+	177.13594	137.7
[M+Na]+	199.11788	142.3
[M-H]-	175.12138	137.2
[M+NH4]+	194.16248	155.5
[M+K]+	215.09182	136.5
[M+H-H2O]+	159.12592	135.1
[M+HCOO]-	221.12686	153.3
[M+CH3COO]-	235.14251	165.6
[M+Na-2H]-	197.10333	147.1
[M]+	176.12811	133.3
[M]-	176.12921	133.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe