CID 84764909

2172473-72-0

Structural Information

Molecular Formula

C₇H₁₃F₂NO

SMILES

CC(C1(CCOCC1)N)(F)F

InChI

InChI=1S/C7H13F2NO/c1-6(8,9)7(10)2-4-11-5-3-7/h2-5,10H2,1H3

InChIKey

BSUNWDBVTSYDIK-UHFFFAOYSA-N

Compound name

4-(1,1-difluoroethyl)oxan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 165.09653 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]+	166.10381	136.4
[M+Na]+	188.08575	144.1
[M+NH4]+	183.13035	144.7
[M+K]+	204.05969	138.2
[M-H]-	164.08925	136.3
[M+Na-2H]-	186.07120	141.0
[M]+	165.09598	137.3
[M]-	165.09708	137.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.