CID 2776791

243139-60-8

Structural Information

Molecular Formula

C₆H₅F₇O₂

SMILES

C1C(O1)CC(C(F)(F)F)(OC(F)(F)F)F

InChI

InChI=1S/C6H5F7O2/c7-4(5(8,9)10,1-3-2-14-3)15-6(11,12)13/h3H,1-2H2

InChIKey

YLTWQTPPDBTMJI-UHFFFAOYSA-N

Compound name

2-[2,3,3,3-tetrafluoro-2-(trifluoromethoxy)propyl]oxirane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 5
Patents: 242.01778 Da
Monoisotopic Mass: 2.8
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]+	243.02506	171.9
[M+Na]+	265.00700	173.5
[M+NH4]+	260.05160	172.6
[M+K]+	280.98094	172.7
[M-H]-	241.01050	168.0
[M+Na-2H]-	262.99245	171.0
[M]+	242.01723	171.1
[M]-	242.01833	171.1

Literature stripe

literature stripe

Patent stripe

patents stripe