CID 165940475

2-bromo-1-fluoro-4-(4-fluorophenoxy)benzene

Structural Information

Molecular Formula
C12H7BrF2O
SMILES
C1=CC(=CC=C1OC2=CC(=C(C=C2)F)Br)F
InChI
InChI=1S/C12H7BrF2O/c13-11-7-10(5-6-12(11)15)16-9-3-1-8(14)2-4-9/h1-7H
InChIKey
QIICFWFYTQPECR-UHFFFAOYSA-N
Compound name
2-bromo-1-fluoro-4-(4-fluorophenoxy)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.96484 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.97212 152.8
[M+Na]+ 306.95406 165.8
[M-H]- 282.95756 160.1
[M+NH4]+ 301.99866 172.5
[M+K]+ 322.92800 153.8
[M+H-H2O]+ 266.96210 150.7
[M+HCOO]- 328.96304 173.3
[M+CH3COO]- 342.97869 196.4
[M+Na-2H]- 304.93951 159.1
[M]+ 283.96429 170.1
[M]- 283.96539 170.1
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

No patent data available for this compound.