CID 277728

1-(2-phthalazin-1-ylhydrazino)phthalazine

Structural Information

Molecular Formula
C16H12N6
SMILES
C1=CC=C2C(=C1)C=NN=C2NNC3=NN=CC4=CC=CC=C43
InChI
InChI=1S/C16H12N6/c1-3-7-13-11(5-1)9-17-19-15(13)21-22-16-14-8-4-2-6-12(14)10-18-20-16/h1-10H,(H,19,21)(H,20,22)
InChIKey
ITXSXNARZIEBGB-UHFFFAOYSA-N
Compound name
1,2-di(phthalazin-1-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.11234 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.11962 162.6
[M+Na]+ 311.10156 172.3
[M-H]- 287.10506 166.0
[M+NH4]+ 306.14616 173.6
[M+K]+ 327.07550 164.7
[M+H-H2O]+ 271.10960 150.9
[M+HCOO]- 333.11054 183.6
[M+CH3COO]- 347.12619 173.1
[M+Na-2H]- 309.08701 177.3
[M]+ 288.11179 162.6
[M]- 288.11289 162.6
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

No patent data available for this compound.