CID 24847632

Valeric acid, 4-hydroxy-, (5-nitrofurfurylidene)hydrazide

Structural Information

Molecular Formula
C10H13N3O5
SMILES
CC(CCC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-])O
InChI
InChI=1S/C10H13N3O5/c1-7(14)2-4-9(15)12-11-6-8-3-5-10(18-8)13(16)17/h3,5-7,14H,2,4H2,1H3,(H,12,15)/b11-6+
InChIKey
WRTPMZBNZKNDJL-IZZDOVSWSA-N
Compound name
4-hydroxy-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.08553 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.09281 155.9
[M+Na]+ 278.07475 163.2
[M+NH4]+ 273.11935 160.6
[M+K]+ 294.04869 165.0
[M-H]- 254.07825 157.9
[M+Na-2H]- 276.06020 157.5
[M]+ 255.08498 156.7
[M]- 255.08608 156.7
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.