CID 17951687

362631-84-3

Structural Information

Molecular Formula

C₃H₅F₃O₂

SMILES

C(COC(F)(F)F)O

InChI

InChI=1S/C3H5F3O2/c4-3(5,6)8-2-1-7/h7H,1-2H2

InChIKey

HZAARXYRNUBDNS-UHFFFAOYSA-N

Compound name

2-(trifluoromethoxy)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 310
Patents: 130.02417 Da
Monoisotopic Mass: 0.6
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]+	131.03145	118.9
[M+Na]+	153.01339	127.5
[M-H]-	129.01689	114.3
[M+NH4]+	148.05799	140.3
[M+K]+	168.98733	127.2
[M+H-H2O]+	113.02143	112.8
[M+HCOO]-	175.02237	137.9
[M+CH3COO]-	189.03802	167.4
[M+Na-2H]-	150.99884	126.0
[M]+	130.02362	115.7
[M]-	130.02472	115.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe