CID 9570503

2-furaldehyde, 5-nitro-, (allylaminoacetyl)hydrazone, acetate

Structural Information

Molecular Formula
C10H12N4O4
SMILES
C=CCNCC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-]
InChI
InChI=1S/C10H12N4O4/c1-2-5-11-7-9(15)13-12-6-8-3-4-10(18-8)14(16)17/h2-4,6,11H,1,5,7H2,(H,13,15)/b12-6+
InChIKey
VYNQBECRDBAZDJ-WUXMJOGZSA-N
Compound name
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-(prop-2-enylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.08586 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.093136 154.6
[M+Na]+ 275.075078 159.1
[M-H]- 251.078584 160.0
[M+NH4]+ 270.119683 170.5
[M+K]+ 291.049018 154.5
[M+H-H2O]+ 235.083120 151.4
[M+HCOO]- 297.084061 183.9
[M+CH3COO]- 311.099711 194.9
[M+Na-2H]- 273.060526 162.1
[M]+ 252.08531142 154.4
[M]- 252.08640858 154.4
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.