CID 9771

2-(2-(2-fluoroethoxy)ethoxy)ethan-1-ol

Structural Information

Molecular Formula

C₆H₁₃FO₃

SMILES

C(COCCOCCF)O

InChI

InChI=1S/C6H13FO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-6H2

InChIKey

SSZYZLZGRCUYIK-UHFFFAOYSA-N

Compound name

2-[2-(2-fluoroethoxy)ethoxy]ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 64
Patents: 152.08487 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]+	153.09215	130.5
[M+Na]+	175.07409	137.2
[M-H]-	151.07759	127.8
[M+NH4]+	170.11869	151.0
[M+K]+	191.04803	137.1
[M+H-H2O]+	135.08213	124.8
[M+HCOO]-	197.08307	152.4
[M+CH3COO]-	211.09872	173.2
[M+Na-2H]-	173.05954	136.5
[M]+	152.08432	133.0
[M]-	152.08542	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe