CID 71756243

1-(furan-2-yl)-2-(morpholin-3-yl)ethan-1-one hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₃NO₃

SMILES

C1COCC(N1)CC(=O)C2=CC=CO2

InChI

InChI=1S/C10H13NO3/c12-9(10-2-1-4-14-10)6-8-7-13-5-3-11-8/h1-2,4,8,11H,3,5-7H2

InChIKey

GYZCJDVHZYQKEU-UHFFFAOYSA-N

Compound name

1-(furan-2-yl)-2-morpholin-3-ylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 195.08954 Da
Monoisotopic Mass: 0.2
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]+	196.096816	142.0
[M+Na]+	218.078758	146.7
[M-H]-	194.082264	146.3
[M+NH4]+	213.123363	157.6
[M+K]+	234.052698	146.9
[M+H-H2O]+	178.086800	135.1
[M+HCOO]-	240.087741	159.2
[M+CH3COO]-	254.103391	177.4
[M+Na-2H]-	216.064206	146.5
[M]+	195.08899142	138.9
[M]-	195.09008858	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.