CID 45054554

N'-(3-(benzyloxy)benzylidene)-4-butoxybenzohydrazide

Structural Information

Molecular Formula
C25H26N2O3
SMILES
CCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=CC(=CC=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C25H26N2O3/c1-2-3-16-29-23-14-12-22(13-15-23)25(28)27-26-18-21-10-7-11-24(17-21)30-19-20-8-5-4-6-9-20/h4-15,17-18H,2-3,16,19H2,1H3,(H,27,28)/b26-18+
InChIKey
FWSFWIUFPHQBJI-NLRVBDNBSA-N
Compound name
4-butoxy-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.19434 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.20162 199.4
[M+Na]+ 425.18356 202.8
[M-H]- 401.18706 209.1
[M+NH4]+ 420.22816 209.2
[M+K]+ 441.15750 197.9
[M+H-H2O]+ 385.19160 187.8
[M+HCOO]- 447.19254 224.6
[M+CH3COO]- 461.20819 229.5
[M+Na-2H]- 423.16901 202.6
[M]+ 402.19379 202.5
[M]- 402.19489 202.5
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.