CID 9644712

2-(4-bromophenoxy)-n'-(4-ethoxybenzylidene)propanohydrazide

Structural Information

Molecular Formula
C18H19BrN2O3
SMILES
CCOC1=CC=C(C=C1)/C=N/NC(=O)C(C)OC2=CC=C(C=C2)Br
InChI
InChI=1S/C18H19BrN2O3/c1-3-23-16-8-4-14(5-9-16)12-20-21-18(22)13(2)24-17-10-6-15(19)7-11-17/h4-13H,3H2,1-2H3,(H,21,22)/b20-12+
InChIKey
OOJOLPQYZXVBFX-UDWIEESQSA-N
Compound name
2-(4-bromophenoxy)-N-[(E)-(4-ethoxyphenyl)methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.05792 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.06520 182.9
[M+Na]+ 413.04714 190.5
[M-H]- 389.05064 192.4
[M+NH4]+ 408.09174 197.7
[M+K]+ 429.02108 179.4
[M+H-H2O]+ 373.05518 179.1
[M+HCOO]- 435.05612 205.4
[M+CH3COO]- 449.07177 221.3
[M+Na-2H]- 411.03259 186.9
[M]+ 390.05737 204.0
[M]- 390.05847 204.0
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.