CID 369225

Nsc640931

Structural Information

Molecular Formula
C10H10N2O4
SMILES
C12C3C4C1(C5C2C3(C45)C(=O)NO)C(=O)NO
InChI
InChI=1S/C10H10N2O4/c13-7(11-15)9-1-2-4(9)6-5(9)3(1)10(2,6)8(14)12-16/h1-6,15-16H,(H,11,13)(H,12,14)
InChIKey
FFCVPSDLKBORSP-UHFFFAOYSA-N
Compound name
1-N,4-N-dihydroxycubane-1,4-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.06406 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.07134 228.4
[M+Na]+ 245.05328 226.2
[M-H]- 221.05678 230.9
[M+NH4]+ 240.09788 222.6
[M+K]+ 261.02722 231.4
[M+H-H2O]+ 205.06132 214.3
[M+HCOO]- 267.06226 228.4
[M+CH3COO]- 281.07791 262.1
[M+Na-2H]- 243.03873 220.4
[M]+ 222.06351 246.5
[M]- 222.06461 246.5
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.