CID 6026246

N'-(4-(benzyloxy)benzylidene)-2-(4-bromophenoxy)propanohydrazide

Structural Information

Molecular Formula
C23H21BrN2O3
SMILES
CC(C(=O)N/N=C/C1=CC=C(C=C1)OCC2=CC=CC=C2)OC3=CC=C(C=C3)Br
InChI
InChI=1S/C23H21BrN2O3/c1-17(29-22-13-9-20(24)10-14-22)23(27)26-25-15-18-7-11-21(12-8-18)28-16-19-5-3-2-4-6-19/h2-15,17H,16H2,1H3,(H,26,27)/b25-15+
InChIKey
KCPBMPSBMDIHST-MFKUBSTISA-N
Compound name
2-(4-bromophenoxy)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

452.07355 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 453.08083 196.6
[M+Na]+ 475.06277 200.4
[M+NH4]+ 470.10737 199.9
[M+K]+ 491.03671 198.2
[M-H]- 451.06627 201.5
[M+Na-2H]- 473.04822 203.0
[M]+ 452.07300 197.3
[M]- 452.07410 197.3
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.