CID 6410697

1-(4-fluorophenoxy)phthalazine

Structural Information

Molecular Formula
C14H9FN2O
SMILES
C1=CC=C2C(=C1)C=NN=C2OC3=CC=C(C=C3)F
InChI
InChI=1S/C14H9FN2O/c15-11-5-7-12(8-6-11)18-14-13-4-2-1-3-10(13)9-16-17-14/h1-9H
InChIKey
JEVRLJZTZLXJMB-UHFFFAOYSA-N
Compound name
1-(4-fluorophenoxy)phthalazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.06989 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.077166 150.9
[M+Na]+ 263.059108 160.8
[M-H]- 239.062614 154.7
[M+NH4]+ 258.103713 166.5
[M+K]+ 279.033048 155.6
[M+H-H2O]+ 223.067150 140.5
[M+HCOO]- 285.068091 171.4
[M+CH3COO]- 299.083741 163.1
[M+Na-2H]- 261.044556 160.0
[M]+ 240.06934142 150.6
[M]- 240.07043858 150.6
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.