CID 6485404

144187-44-0

Structural Information

Molecular Formula

C₁₀H₁₃FN₂O

SMILES

C1COCCN1C2=C(C=C(C=C2)F)N

InChI

InChI=1S/C10H13FN2O/c11-8-1-2-10(9(12)7-8)13-3-5-14-6-4-13/h1-2,7H,3-6,12H2

InChIKey

NSVHSRBHIFWVGP-UHFFFAOYSA-N

Compound name

5-fluoro-2-morpholin-4-ylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 54
Patents: 196.1012 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]+	197.10848	142.1
[M+Na]+	219.09042	148.6
[M-H]-	195.09392	146.0
[M+NH4]+	214.13502	158.1
[M+K]+	235.06436	146.6
[M+H-H2O]+	179.09846	133.4
[M+HCOO]-	241.09940	160.8
[M+CH3COO]-	255.11505	184.8
[M+Na-2H]-	217.07587	147.4
[M]+	196.10065	136.0
[M]-	196.10175	136.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe