CID 9570506

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

Structural Information

Molecular Formula
C10H14N4O4
SMILES
CCCNCC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-]
InChI
InChI=1S/C10H14N4O4/c1-2-5-11-7-9(15)13-12-6-8-3-4-10(18-8)14(16)17/h3-4,6,11H,2,5,7H2,1H3,(H,13,15)/b12-6+
InChIKey
HWZSPXRMMCWSGN-WUXMJOGZSA-N
Compound name
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-(propylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.1015 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.108776 155.5
[M+Na]+ 277.090718 159.6
[M-H]- 253.094224 160.8
[M+NH4]+ 272.135323 171.4
[M+K]+ 293.064658 155.7
[M+H-H2O]+ 237.098760 152.2
[M+HCOO]- 299.099701 184.6
[M+CH3COO]- 313.115351 195.8
[M+Na-2H]- 275.076166 162.9
[M]+ 254.10095142 155.9
[M]- 254.10204858 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.