CID 82612678

2-(4-fluoro-3-methoxyphenyl)morpholine

Structural Information

Molecular Formula

C₁₁H₁₄FNO₂

SMILES

COC1=C(C=CC(=C1)C2CNCCO2)F

InChI

InChI=1S/C11H14FNO2/c1-14-10-6-8(2-3-9(10)12)11-7-13-4-5-15-11/h2-3,6,11,13H,4-5,7H2,1H3

InChIKey

QGZXXACRUFZISH-UHFFFAOYSA-N

Compound name

2-(4-fluoro-3-methoxyphenyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 211.10086 Da
Monoisotopic Mass: 1.4
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]+	212.108136	145.4
[M+Na]+	234.090078	151.8
[M-H]-	210.093584	148.2
[M+NH4]+	229.134683	160.6
[M+K]+	250.064018	149.7
[M+H-H2O]+	194.098120	136.9
[M+HCOO]-	256.099061	162.1
[M+CH3COO]-	270.114711	183.1
[M+Na-2H]-	232.075526	150.3
[M]+	211.10031142	140.9
[M]-	211.10140858	140.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.