CID 24274293

886365-63-5

Structural Information

Molecular Formula

C₁₀H₁₂FN

SMILES

C1CC1(CN)C2=CC=CC=C2F

InChI

InChI=1S/C10H12FN/c11-9-4-2-1-3-8(9)10(7-12)5-6-10/h1-4H,5-7,12H2

InChIKey

BPLHMJLSKPXLEI-UHFFFAOYSA-N

Compound name

[1-(2-fluorophenyl)cyclopropyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 165.09538 Da
Monoisotopic Mass: 1.6
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]+	166.10266	129.7
[M+Na]+	188.08460	139.4
[M-H]-	164.08810	136.0
[M+NH4]+	183.12920	147.0
[M+K]+	204.05854	136.6
[M+H-H2O]+	148.09264	123.3
[M+HCOO]-	210.09358	153.6
[M+CH3COO]-	224.10923	183.7
[M+Na-2H]-	186.07005	137.2
[M]+	165.09483	129.2
[M]-	165.09593	129.2

Literature stripe

literature stripe

Patent stripe

patents stripe