CID 9570491

2-furaldehyde, 5-nitro-, (1-pyrrolidinylacetyl)hydrazone, hydrochloride

Structural Information

Molecular Formula
C11H14N4O4
SMILES
C1CCN(C1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-]
InChI
InChI=1S/C11H14N4O4/c16-10(8-14-5-1-2-6-14)13-12-7-9-3-4-11(19-9)15(17)18/h3-4,7H,1-2,5-6,8H2,(H,13,16)/b12-7+
InChIKey
FUZYIZXPUCEIDG-KPKJPENVSA-N
Compound name
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-pyrrolidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1015 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.108776 158.4
[M+Na]+ 289.090718 161.7
[M-H]- 265.094224 165.4
[M+NH4]+ 284.135323 174.0
[M+K]+ 305.064658 157.8
[M+H-H2O]+ 249.098760 154.7
[M+HCOO]- 311.099701 184.3
[M+CH3COO]- 325.115351 193.2
[M+Na-2H]- 287.076166 163.7
[M]+ 266.10095142 155.9
[M]- 266.10204858 155.9
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.