CID 45054576

4-((4-chlorobenzyl)oxy)-n'-(1-naphthylmethylene)benzohydrazide

Structural Information

Molecular Formula
C25H19ClN2O2
SMILES
C1=CC=C2C(=C1)C=CC=C2/C=N/NC(=O)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl
InChI
InChI=1S/C25H19ClN2O2/c26-22-12-8-18(9-13-22)17-30-23-14-10-20(11-15-23)25(29)28-27-16-21-6-3-5-19-4-1-2-7-24(19)21/h1-16H,17H2,(H,28,29)/b27-16+
InChIKey
VVVZCGKQPNUVFH-JVWAILMASA-N
Compound name
4-[(4-chlorophenyl)methoxy]-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

414.1135 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.12078 199.6
[M+Na]+ 437.10272 206.3
[M-H]- 413.10622 210.5
[M+NH4]+ 432.14732 211.0
[M+K]+ 453.07666 198.8
[M+H-H2O]+ 397.11076 188.9
[M+HCOO]- 459.11170 219.6
[M+CH3COO]- 473.12735 209.1
[M+Na-2H]- 435.08817 204.6
[M]+ 414.11295 203.1
[M]- 414.11405 203.1
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.