CID 9463

2-(2-fluoroethoxy)naphthalene

Structural Information

Molecular Formula
C12H11FO
SMILES
C1=CC=C2C=C(C=CC2=C1)OCCF
InChI
InChI=1S/C12H11FO/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8H2
InChIKey
YBWQLWHKAXEHPH-UHFFFAOYSA-N
Compound name
2-(2-fluoroethoxy)naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

190.07939 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.08667 137.5
[M+Na]+ 213.06861 146.1
[M-H]- 189.07211 140.7
[M+NH4]+ 208.11321 158.3
[M+K]+ 229.04255 142.7
[M+H-H2O]+ 173.07665 130.4
[M+HCOO]- 235.07759 160.2
[M+CH3COO]- 249.09324 183.7
[M+Na-2H]- 211.05406 146.1
[M]+ 190.07884 137.9
[M]- 190.07994 137.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe