CID 131006662

2-amino-3-(3,3-difluorocyclobutyl)propan-1-ol hydrochloride

Structural Information

Molecular Formula

C₇H₁₃F₂NO

SMILES

C1C(CC1(F)F)CC(CO)N

InChI

InChI=1S/C7H13F2NO/c8-7(9)2-5(3-7)1-6(10)4-11/h5-6,11H,1-4,10H2

InChIKey

PHAQMULESNNCBQ-UHFFFAOYSA-N

Compound name

2-amino-3-(3,3-difluorocyclobutyl)propan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 165.09653 Da
Monoisotopic Mass: 0.4
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	142.1
[M+Na]+	188.08575	144.9
[M+NH4]+	183.13035	145.8
[M+K]+	204.05969	140.5
[M-H]-	164.08925	137.3
[M+Na-2H]-	186.07120	142.8
[M]+	165.09598	139.7
[M]-	165.09708	139.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe