CID 66275245

3-[(1,1,1-trifluoropropan-2-yl)oxy]azetidine hydrochloride

Structural Information

Molecular Formula

C₆H₁₀F₃NO

SMILES

CC(C(F)(F)F)OC1CNC1

InChI

InChI=1S/C6H10F3NO/c1-4(6(7,8)9)11-5-2-10-3-5/h4-5,10H,2-3H2,1H3

InChIKey

SODVEOFMHDTURM-UHFFFAOYSA-N

Compound name

3-(1,1,1-trifluoropropan-2-yloxy)azetidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 169.07144 Da
Monoisotopic Mass: 1.0
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]+	170.07872	145.1
[M+Na]+	192.06066	147.6
[M+NH4]+	187.10526	146.5
[M+K]+	208.03460	145.5
[M-H]-	168.06416	137.7
[M+Na-2H]-	190.04611	144.1
[M]+	169.07089	141.8
[M]-	169.07199	141.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe