CID 9570870

Butyric acid, 2-ethyl-4-hydroxy-, (5-nitrofurfurylidene)hydrazide

Structural Information

Molecular Formula
C11H15N3O5
SMILES
CCC(CCO)C(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-]
InChI
InChI=1S/C11H15N3O5/c1-2-8(5-6-15)11(16)13-12-7-9-3-4-10(19-9)14(17)18/h3-4,7-8,15H,2,5-6H2,1H3,(H,13,16)/b12-7+
InChIKey
KVMJVWQQKSJBBE-KPKJPENVSA-N
Compound name
2-ethyl-4-hydroxy-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.10117 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.10845 160.3
[M+Na]+ 292.09039 167.4
[M+NH4]+ 287.13499 164.8
[M+K]+ 308.06433 168.9
[M-H]- 268.09389 162.3
[M+Na-2H]- 290.07584 161.7
[M]+ 269.10062 161.1
[M]- 269.10172 161.1
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.