CID 14257298

74483-53-7

Structural Information

Molecular Formula
C13H11FO
SMILES
CC1=CC(=C(C=C1)F)OC2=CC=CC=C2
InChI
InChI=1S/C13H11FO/c1-10-7-8-12(14)13(9-10)15-11-5-3-2-4-6-11/h2-9H,1H3
InChIKey
ILKFYEKKPVEUOK-UHFFFAOYSA-N
Compound name
1-fluoro-4-methyl-2-phenoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

281
Patents

202.07939 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.086666 140.6
[M+Na]+ 225.068608 149.7
[M-H]- 201.072114 146.6
[M+NH4]+ 220.113213 159.9
[M+K]+ 241.042548 146.2
[M+H-H2O]+ 185.076650 132.9
[M+HCOO]- 247.077591 164.6
[M+CH3COO]- 261.093241 186.0
[M+Na-2H]- 223.054056 147.3
[M]+ 202.07884142 140.5
[M]- 202.07993858 140.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe