CID 212331

24159-21-5

Structural Information

Molecular Formula
C9H9F3N6
SMILES
C1=CC2=C(C=C1C(F)(F)F)C(=NN=C2NN)NN
InChI
InChI=1S/C9H9F3N6/c10-9(11,12)4-1-2-5-6(3-4)8(16-14)18-17-7(5)15-13/h1-3H,13-14H2,(H,15,17)(H,16,18)
InChIKey
UGKIKLGUIHXYDA-UHFFFAOYSA-N
Compound name
[4-hydrazinyl-6-(trifluoromethyl)phthalazin-1-yl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.08408 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.09136 150.4
[M+Na]+ 281.07330 159.6
[M-H]- 257.07680 148.5
[M+NH4]+ 276.11790 164.5
[M+K]+ 297.04724 154.8
[M+H-H2O]+ 241.08134 140.1
[M+HCOO]- 303.08228 170.4
[M+CH3COO]- 317.09793 204.8
[M+Na-2H]- 279.05875 158.7
[M]+ 258.08353 142.8
[M]- 258.08463 142.8
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.