CID 6320100

1,3-cyclopentanedione, bis[(diaminomethyl)hydrazone], (1z,3e)-

Structural Information

Molecular Formula
C7H18N8
SMILES
C\1C/C(=N/NC(N)N)/C/C1=N/NC(N)N
InChI
InChI=1S/C7H18N8/c8-6(9)14-12-4-1-2-5(3-4)13-15-7(10)11/h6-7,14-15H,1-3,8-11H2/b12-4-,13-5+
InChIKey
DCVISKQTELOERJ-JBWWEBJPSA-N
Compound name
N\""-[(Z)-[(3E)-3-(diaminomethylhydrazinylidene)cyclopentylidene]amino]methanetriamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.16544 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.17272 139.1
[M+Na]+ 237.15466 140.3
[M-H]- 213.15816 143.2
[M+NH4]+ 232.19926 156.4
[M+K]+ 253.12860 140.9
[M+H-H2O]+ 197.16270 129.7
[M+HCOO]- 259.16364 168.5
[M+CH3COO]- 273.17929 210.7
[M+Na-2H]- 235.14011 141.5
[M]+ 214.16489 127.6
[M]- 214.16599 127.6
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.