CID 3831072

3-(4-fluorophenyl)morpholine

Structural Information

Molecular Formula

C₁₀H₁₂FNO

SMILES

C1COCC(N1)C2=CC=C(C=C2)F

InChI

InChI=1S/C10H12FNO/c11-9-3-1-8(2-4-9)10-7-13-6-5-12-10/h1-4,10,12H,5-7H2

InChIKey

VURZDWDKDQRYTJ-UHFFFAOYSA-N

Compound name

3-(4-fluorophenyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 32
Patents: 181.09029 Da
Monoisotopic Mass: 1.1
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]+	182.09757	140.1
[M+Na]+	204.07951	152.6
[M+NH4]+	199.12411	148.6
[M+K]+	220.05345	145.9
[M-H]-	180.08301	143.7
[M+Na-2H]-	202.06496	147.0
[M]+	181.08974	142.8
[M]-	181.09084	142.8

Literature stripe

literature stripe

Patent stripe

patents stripe