CID 5362272

Benzoic acid, p-amino-, 2-(5-nitro-2-furyl)hydrazide

Structural Information

Molecular Formula
C11H10N4O4
SMILES
C1=CC(=C(C=C1N)C2=CC=C(O2)[N+](=O)[O-])C(=O)NN
InChI
InChI=1S/C11H10N4O4/c12-6-1-2-7(11(16)14-13)8(5-6)9-3-4-10(19-9)15(17)18/h1-5H,12-13H2,(H,14,16)
InChIKey
NEOLWSHTDCFHKS-UHFFFAOYSA-N
Compound name
4-amino-2-(5-nitrofuran-2-yl)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.0702 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.077476 153.6
[M+Na]+ 285.059418 159.3
[M-H]- 261.062924 160.9
[M+NH4]+ 280.104023 168.1
[M+K]+ 301.033358 153.8
[M+H-H2O]+ 245.067460 150.3
[M+HCOO]- 307.068401 180.9
[M+CH3COO]- 321.084051 194.9
[M+Na-2H]- 283.044866 159.4
[M]+ 262.06965142 150.0
[M]- 262.07074858 150.0
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.