CID 5747930

Brn 5971012

Structural Information

Molecular Formula
C12H13N5O2
SMILES
COC1=C(C=C2C(=C1)C3=CN=NC(=C3N2)NN)OC
InChI
InChI=1S/C12H13N5O2/c1-18-9-3-6-7-5-14-17-12(16-13)11(7)15-8(6)4-10(9)19-2/h3-5,15H,13H2,1-2H3,(H,16,17)
InChIKey
SBXKADCBXGSNKD-UHFFFAOYSA-N
Compound name
(7,8-dimethoxy-5H-pyridazino[4,5-b]indol-4-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.10693 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.11421 154.8
[M+Na]+ 282.09615 166.0
[M-H]- 258.09965 156.1
[M+NH4]+ 277.14075 170.7
[M+K]+ 298.07009 161.2
[M+H-H2O]+ 242.10419 146.6
[M+HCOO]- 304.10513 176.6
[M+CH3COO]- 318.12078 166.8
[M+Na-2H]- 280.08160 163.0
[M]+ 259.10638 157.5
[M]- 259.10748 157.5
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.