CID 45054626

N'-(2-bromobenzylidene)-4-((4-methylbenzyl)oxy)benzohydrazide

Structural Information

Molecular Formula
C22H19BrN2O2
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CC=C3Br
InChI
InChI=1S/C22H19BrN2O2/c1-16-6-8-17(9-7-16)15-27-20-12-10-18(11-13-20)22(26)25-24-14-19-4-2-3-5-21(19)23/h2-14H,15H2,1H3,(H,25,26)/b24-14+
InChIKey
MBDJGTKWPKHVIF-ZVHZXABRSA-N
Compound name
N-[(E)-(2-bromophenyl)methylideneamino]-4-[(4-methylphenyl)methoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

422.063 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.07028 190.4
[M+Na]+ 445.05222 195.5
[M+NH4]+ 440.09682 194.5
[M+K]+ 461.02616 192.4
[M-H]- 421.05572 196.0
[M+Na-2H]- 443.03767 197.5
[M]+ 422.06245 191.6
[M]- 422.06355 191.6
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.