CID 135560176

2-((1-bromo-2-naphthyl)oxy)-n'-(3-ethoxy-4-hydroxybenzylidene)acetohydrazide

Structural Information

Molecular Formula
C21H19BrN2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)COC2=C(C3=CC=CC=C3C=C2)Br)O
InChI
InChI=1S/C21H19BrN2O4/c1-2-27-19-11-14(7-9-17(19)25)12-23-24-20(26)13-28-18-10-8-15-5-3-4-6-16(15)21(18)22/h3-12,25H,2,13H2,1H3,(H,24,26)/b23-12+
InChIKey
URDPPUYFGXUEHR-FSJBWODESA-N
Compound name
2-(1-bromonaphthalen-2-yl)oxy-N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.05283 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.06011 194.5
[M+Na]+ 465.04205 202.8
[M-H]- 441.04555 203.7
[M+NH4]+ 460.08665 207.6
[M+K]+ 481.01599 190.9
[M+H-H2O]+ 425.05009 190.4
[M+HCOO]- 487.05103 215.1
[M+CH3COO]- 501.06668 229.0
[M+Na-2H]- 463.02750 199.4
[M]+ 442.05228 216.1
[M]- 442.05338 216.1
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.