CID 9556658

2-(2-methoxyphenoxy)-n'-(4-nitrobenzylidene)acetohydrazide

Structural Information

Molecular Formula
C16H15N3O5
SMILES
COC1=CC=CC=C1OCC(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C16H15N3O5/c1-23-14-4-2-3-5-15(14)24-11-16(20)18-17-10-12-6-8-13(9-7-12)19(21)22/h2-10H,11H2,1H3,(H,18,20)/b17-10+
InChIKey
FSMZWYDUWDXJAP-LICLKQGHSA-N
Compound name
2-(2-methoxyphenoxy)-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.10117 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.10845 172.8
[M+Na]+ 352.09039 177.0
[M-H]- 328.09389 180.5
[M+NH4]+ 347.13499 185.1
[M+K]+ 368.06433 171.0
[M+H-H2O]+ 312.09843 167.7
[M+HCOO]- 374.09937 200.7
[M+CH3COO]- 388.11502 208.0
[M+Na-2H]- 350.07584 179.8
[M]+ 329.10062 174.2
[M]- 329.10172 174.2
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.