CID 51060287

2-(4-bromophenoxy)-n'-(4-((4-methylbenzyl)oxy)benzylidene)propanohydrazide

Structural Information

Molecular Formula
C24H23BrN2O3
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C(C)OC3=CC=C(C=C3)Br
InChI
InChI=1S/C24H23BrN2O3/c1-17-3-5-20(6-4-17)16-29-22-11-7-19(8-12-22)15-26-27-24(28)18(2)30-23-13-9-21(25)10-14-23/h3-15,18H,16H2,1-2H3,(H,27,28)/b26-15+
InChIKey
YTONPUYYYIIYDI-CVKSISIWSA-N
Compound name
2-(4-bromophenoxy)-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

466.0892 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.09648 204.9
[M+Na]+ 489.07842 211.4
[M-H]- 465.08192 216.8
[M+NH4]+ 484.12302 216.2
[M+K]+ 505.05236 199.6
[M+H-H2O]+ 449.08646 199.8
[M+HCOO]- 511.08740 226.4
[M+CH3COO]- 525.10305 235.2
[M+Na-2H]- 487.06387 207.3
[M]+ 466.08865 225.6
[M]- 466.08975 225.6
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.