CID 342308

71257-33-5

Structural Information

Molecular Formula
C20H14N2S2
SMILES
C1=CC=C(C=C1)N2C(=S)C3=CC=CC=C3C(=S)N2C4=CC=CC=C4
InChI
InChI=1S/C20H14N2S2/c23-19-17-13-7-8-14-18(17)20(24)22(16-11-5-2-6-12-16)21(19)15-9-3-1-4-10-15/h1-14H
InChIKey
RACYKTCVMVALML-UHFFFAOYSA-N
Compound name
2,3-diphenylphthalazine-1,4-dithione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

346.05984 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.06712 176.0
[M+Na]+ 369.04906 188.1
[M-H]- 345.05256 184.1
[M+NH4]+ 364.09366 188.6
[M+K]+ 385.02300 177.8
[M+H-H2O]+ 329.05710 167.1
[M+HCOO]- 391.05804 187.2
[M+CH3COO]- 405.07369 186.7
[M+Na-2H]- 367.03451 179.3
[M]+ 346.05929 177.5
[M]- 346.06039 177.5
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.