CID 9570025

Nsc633914

Structural Information

Molecular Formula
C9H14N6O2
SMILES
C/C(=N\N=C(N)N)/CCN1C(=O)C=CC(=O)N1
InChI
InChI=1S/C9H14N6O2/c1-6(12-13-9(10)11)4-5-15-8(17)3-2-7(16)14-15/h2-3H,4-5H2,1H3,(H,14,16)(H4,10,11,13)/b12-6+
InChIKey
MZKAJJOOGPKICS-WUXMJOGZSA-N
Compound name
2-[(E)-4-(3,6-dioxo-1H-pyridazin-2-yl)butan-2-ylideneamino]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.11783 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.12511 151.7
[M+Na]+ 261.10705 158.7
[M-H]- 237.11055 153.8
[M+NH4]+ 256.15165 165.7
[M+K]+ 277.08099 156.3
[M+H-H2O]+ 221.11509 142.8
[M+HCOO]- 283.11603 177.2
[M+CH3COO]- 297.13168 202.3
[M+Na-2H]- 259.09250 156.1
[M]+ 238.11728 148.9
[M]- 238.11838 148.9
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.