CID 9570506

5-nitro-2-furaldehyde (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]+ 255.10878 155.5
[M+Na]+ 277.09072 159.6
[M-H]- 253.09422 160.8
[M+NH4]+ 272.13532 171.4
[M+K]+ 293.06466 155.7
[M+H-H2O]+ 237.09876 152.2
[M+HCOO]- 299.09970 184.6
[M+CH3COO]- 313.11535 195.8
[M+Na-2H]- 275.07617 162.9
[M]+ 254.10095 155.9
[M]- 254.10205 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.