CID 58335728

3-(3-fluorophenyl)morpholine hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₂FNO

SMILES

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

InChI

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

InChIKey

HEADMLCVFDCVMU-UHFFFAOYSA-N

Compound name

3-(3-fluorophenyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
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	137.5
[M+Na]+	204.07951	143.4
[M-H]-	180.08301	140.1
[M+NH4]+	199.12411	153.7
[M+K]+	220.05345	141.1
[M+H-H2O]+	164.08755	129.2
[M+HCOO]-	226.08849	154.3
[M+CH3COO]-	240.10414	149.1
[M+Na-2H]-	202.06496	143.7
[M]+	181.08974	130.8
[M]-	181.09084	130.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe