CID 45054666

N'-(3-fluorobenzylidene)-4-((4-methylbenzyl)oxy)benzohydrazide

Structural Information

Molecular Formula
C22H19FN2O2
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=CC(=CC=C3)F
InChI
InChI=1S/C22H19FN2O2/c1-16-5-7-17(8-6-16)15-27-21-11-9-19(10-12-21)22(26)25-24-14-18-3-2-4-20(23)13-18/h2-14H,15H2,1H3,(H,25,26)/b24-14+
InChIKey
KQIYDKOTBIPGGD-ZVHZXABRSA-N
Compound name
N-[(E)-(3-fluorophenyl)methylideneamino]-4-[(4-methylphenyl)methoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.14307 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.15035 186.7
[M+Na]+ 385.13229 192.7
[M-H]- 361.13579 196.1
[M+NH4]+ 380.17689 198.6
[M+K]+ 401.10623 187.3
[M+H-H2O]+ 345.14033 175.1
[M+HCOO]- 407.14127 211.7
[M+CH3COO]- 421.15692 222.4
[M+Na-2H]- 383.11774 190.1
[M]+ 362.14252 186.9
[M]- 362.14362 186.9
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.