CID 9561843

Nsc80205

Structural Information

Molecular Formula
C8H18N8O4
SMILES
C(C(C(C(/C(=N/N=C(N)N)/C=N/N=C(N)N)O)O)O)O
InChI
InChI=1S/C8H18N8O4/c9-7(10)15-13-1-3(14-16-8(11)12)5(19)6(20)4(18)2-17/h1,4-6,17-20H,2H2,(H4,9,10,15)(H4,11,12,16)/b13-1+,14-3+
InChIKey
OZSNIAZMEQYKFP-ROOPDFDPSA-N
Compound name
2-[(E)-[(1E)-1-(diaminomethylidenehydrazinylidene)-3,4,5,6-tetrahydroxyhexan-2-ylidene]amino]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.1451 Da
Monoisotopic Mass

-4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.15238 161.0
[M+Na]+ 313.13432 160.4
[M-H]- 289.13782 159.3
[M+NH4]+ 308.17892 171.7
[M+K]+ 329.10826 163.4
[M+H-H2O]+ 273.14236 151.4
[M+HCOO]- 335.14330 185.0
[M+CH3COO]- 349.15895 222.9
[M+Na-2H]- 311.11977 157.9
[M]+ 290.14455 151.2
[M]- 290.14565 151.2
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.