CID 9615919

303083-48-9

Structural Information

Molecular Formula
C19H15N3O4
SMILES
C1=CC=C2C(=C1)C=CC=C2OCC(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C19H15N3O4/c23-19(21-20-12-14-8-10-16(11-9-14)22(24)25)13-26-18-7-3-5-15-4-1-2-6-17(15)18/h1-12H,13H2,(H,21,23)/b20-12+
InChIKey
ZHYURVQCDFHBDT-UDWIEESQSA-N
Compound name
2-naphthalen-1-yloxy-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.10626 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.11354 177.5
[M+Na]+ 372.09548 181.5
[M-H]- 348.09898 185.6
[M+NH4]+ 367.14008 189.6
[M+K]+ 388.06942 173.8
[M+H-H2O]+ 332.10352 171.9
[M+HCOO]- 394.10446 203.8
[M+CH3COO]- 408.12011 212.7
[M+Na-2H]- 370.08093 186.1
[M]+ 349.10571 177.3
[M]- 349.10681 177.3
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.