CID 155973045

2648948-92-7

Structural Information

Molecular Formula

SMILES

C1C2(CC1(OC2)CN)F

InChI

InChI=1S/C6H10FNO/c7-5-1-6(2-5,3-8)9-4-5/h1-4,8H2

InChIKey

KMVTYGKTQCYQCX-UHFFFAOYSA-N

Compound name

(4-fluoro-2-oxabicyclo[2.1.1]hexan-1-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 131.07465 Da
Monoisotopic Mass: -0.5
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]+	132.08193	129.1
[M+Na]+	154.06387	136.4
[M-H]-	130.06737	129.8
[M+NH4]+	149.10847	153.6
[M+K]+	170.03781	138.1
[M+H-H2O]+	114.07191	122.6
[M+HCOO]-	176.07285	147.0
[M+CH3COO]-	190.08850	142.5
[M+Na-2H]-	152.04932	139.1
[M]+	131.07410	139.7
[M]-	131.07520	139.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.