CID 328192

17635-31-3

Structural Information

Molecular Formula
C28H20N2O2
SMILES
C1=CC=C2C(=C1)C=CC(=C2C=NC3=CC=C(C=C3)N=CC4=C(C=CC5=CC=CC=C54)O)O
InChI
InChI=1S/C28H20N2O2/c31-27-15-9-19-5-1-3-7-23(19)25(27)17-29-21-11-13-22(14-12-21)30-18-26-24-8-4-2-6-20(24)10-16-28(26)32/h1-18,31-32H
InChIKey
AEIQAMSFNASQDD-UHFFFAOYSA-N
Compound name
1-[[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]iminomethyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
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 200.9
[M+Na]+ 439.14169 209.2
[M-H]- 415.14519 212.3
[M+NH4]+ 434.18629 211.9
[M+K]+ 455.11563 201.0
[M+H-H2O]+ 399.14973 189.1
[M+HCOO]- 461.15067 224.5
[M+CH3COO]- 475.16632 210.5
[M+Na-2H]- 437.12714 208.2
[M]+ 416.15192 202.2
[M]- 416.15302 202.2
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