CID 6410688

1-(4-methoxyphenyl)phthalazine

Structural Information

Molecular Formula
C15H12N2O2
SMILES
COC1=CC=C(C=C1)OC2=NN=CC3=CC=CC=C32
InChI
InChI=1S/C15H12N2O2/c1-18-12-6-8-13(9-7-12)19-15-14-5-3-2-4-11(14)10-16-17-15/h2-10H,1H3
InChIKey
KSJGWCHEBUIOMI-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenoxy)phthalazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.08987 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.09715 156.0
[M+Na]+ 275.07909 173.2
[M+NH4]+ 270.12369 165.0
[M+K]+ 291.05303 164.5
[M-H]- 251.08259 160.8
[M+Na-2H]- 273.06454 166.7
[M]+ 252.08932 160.1
[M]- 252.09042 160.1
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.