CID 88536

Einecs 243-820-6

Structural Information

Molecular Formula
C28H20N2O2
SMILES
C1=CC=C2C(=C1)C=CC(=C2C=NC3=CC=CC=C3N=CC4=C(C=CC5=CC=CC=C54)O)O
InChI
InChI=1S/C28H20N2O2/c31-27-15-13-19-7-1-3-9-21(19)23(27)17-29-25-11-5-6-12-26(25)30-18-24-22-10-4-2-8-20(22)14-16-28(24)32/h1-18,31-32H
InChIKey
KVDCEOOVOSUMOB-UHFFFAOYSA-N
Compound name
1-[[2-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]iminomethyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

416.15247 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.15975 204.2
[M+Na]+ 439.14169 223.3
[M+NH4]+ 434.18629 213.4
[M+K]+ 455.11563 210.8
[M-H]- 415.14519 214.5
[M+Na-2H]- 437.12714 216.5
[M]+ 416.15192 210.2
[M]- 416.15302 210.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe