CID 137698858

1866507-83-6

Structural Information

Molecular Formula

C₈H₁₆F₂N₂O

SMILES

C1COCCN1C(CCN)C(F)F

InChI

InChI=1S/C8H16F2N2O/c9-8(10)7(1-2-11)12-3-5-13-6-4-12/h7-8H,1-6,11H2

InChIKey

OLMFDQSJJRJOPT-UHFFFAOYSA-N

Compound name

4,4-difluoro-3-morpholin-4-ylbutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 194.12306 Da
Monoisotopic Mass: 0.2
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]+	195.13034	144.2
[M+Na]+	217.11228	147.6
[M-H]-	193.11578	142.5
[M+NH4]+	212.15688	159.7
[M+K]+	233.08622	147.5
[M+H-H2O]+	177.12032	135.1
[M+HCOO]-	239.12126	158.9
[M+CH3COO]-	253.13691	185.4
[M+Na-2H]-	215.09773	146.2
[M]+	194.12251	136.5
[M]-	194.12361	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.