CID 9570858

Butyric acid, 3-hydroxy-, (5-nitrofurfurylidene)hydrazide

Structural Information

Molecular Formula
C9H11N3O5
SMILES
CC(CC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-])O
InChI
InChI=1S/C9H11N3O5/c1-6(13)4-8(14)11-10-5-7-2-3-9(17-7)12(15)16/h2-3,5-6,13H,4H2,1H3,(H,11,14)/b10-5+
InChIKey
YTGUKPMBXFQAFZ-BJMVGYQFSA-N
Compound name
3-hydroxy-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.06987 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.07715 151.5
[M+Na]+ 264.05909 159.0
[M+NH4]+ 259.10369 156.3
[M+K]+ 280.03303 161.0
[M-H]- 240.06259 153.5
[M+Na-2H]- 262.04454 153.3
[M]+ 241.06932 152.4
[M]- 241.07042 152.4
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.