CID 91944841

4-((4-methylbenzyl)oxy)-n'-((4-oxo-4h-chromen-3-yl)methylene)benzohydrazide

Structural Information

Molecular Formula
C25H20N2O4
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NN=CC3=COC4=CC=CC=C4C3=O
InChI
InChI=1S/C25H20N2O4/c1-17-6-8-18(9-7-17)15-30-21-12-10-19(11-13-21)25(29)27-26-14-20-16-31-23-5-3-2-4-22(23)24(20)28/h2-14,16H,15H2,1H3,(H,27,29)
InChIKey
OWWWLTJVODPWIN-UHFFFAOYSA-N
Compound name
4-[(4-methylphenyl)methoxy]-N-[(4-oxochromen-3-yl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.1423 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.14958 199.9
[M+Na]+ 435.13152 216.1
[M+NH4]+ 430.17612 207.0
[M+K]+ 451.10546 206.8
[M-H]- 411.13502 209.3
[M+Na-2H]- 433.11697 210.1
[M]+ 412.14175 205.0
[M]- 412.14285 205.0
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.