CID 51060452

N'-(4-((4-methylbenzyl)oxy)benzylidene)-2-(1-naphthyloxy)propanohydrazide

Structural Information

Molecular Formula
C28H26N2O3
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C(C)OC3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C28H26N2O3/c1-20-10-12-23(13-11-20)19-32-25-16-14-22(15-17-25)18-29-30-28(31)21(2)33-27-9-5-7-24-6-3-4-8-26(24)27/h3-18,21H,19H2,1-2H3,(H,30,31)/b29-18+
InChIKey
PXRAGEVACWRTHO-RDRPBHBLSA-N
Compound name
N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-yloxypropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

438.19434 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.20162 208.6
[M+Na]+ 461.18356 212.3
[M-H]- 437.18706 219.1
[M+NH4]+ 456.22816 217.6
[M+K]+ 477.15750 207.2
[M+H-H2O]+ 421.19160 196.5
[M+HCOO]- 483.19254 231.0
[M+CH3COO]- 497.20819 238.2
[M+Na-2H]- 459.16901 211.5
[M]+ 438.19379 210.9
[M]- 438.19489 210.9
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.