CID 45054868

3-methyl-n'-(4-((4-methylbenzyl)oxy)benzylidene)benzohydrazide

Structural Information

Molecular Formula
C23H22N2O2
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C3=CC=CC(=C3)C
InChI
InChI=1S/C23H22N2O2/c1-17-6-8-20(9-7-17)16-27-22-12-10-19(11-13-22)15-24-25-23(26)21-5-3-4-18(2)14-21/h3-15H,16H2,1-2H3,(H,25,26)/b24-15+
InChIKey
NXVVCEKMKJRBRU-BUVRLJJBSA-N
Compound name
3-methyl-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.16812 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.17540 188.0
[M+Na]+ 381.15734 193.5
[M-H]- 357.16084 198.6
[M+NH4]+ 376.20194 200.2
[M+K]+ 397.13128 188.4
[M+H-H2O]+ 341.16538 177.3
[M+HCOO]- 403.16632 213.7
[M+CH3COO]- 417.18197 222.8
[M+Na-2H]- 379.14279 191.5
[M]+ 358.16757 189.6
[M]- 358.16867 189.6
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.