CID 9570394

Brn 0898403

Structural Information

Molecular Formula
C15H23N5O4
SMILES
CCCCN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-]
InChI
InChI=1S/C15H23N5O4/c1-2-3-6-18-7-9-19(10-8-18)12-14(21)17-16-11-13-4-5-15(24-13)20(22)23/h4-5,11H,2-3,6-10,12H2,1H3,(H,17,21)/b16-11+
InChIKey
CFPOQCPZKHPNPN-LFIBNONCSA-N
Compound name
2-(4-butylpiperazin-1-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17502 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.18230 178.0
[M+Na]+ 360.16424 185.7
[M+NH4]+ 355.20884 182.3
[M+K]+ 376.13818 185.8
[M-H]- 336.16774 181.8
[M+Na-2H]- 358.14969 180.4
[M]+ 337.17447 179.4
[M]- 337.17557 179.4
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.