CID 222842

65283-60-5

Structural Information

Molecular Formula
C20H12Br2O2
SMILES
C1=CC2=C(C=CC(=C2C3=C(C=CC4=C3C=CC(=C4)Br)O)O)C=C1Br
InChI
InChI=1S/C20H12Br2O2/c21-13-3-5-15-11(9-13)1-7-17(23)19(15)20-16-6-4-14(22)10-12(16)2-8-18(20)24/h1-10,23-24H
InChIKey
OORIFUHRGQKYEV-UHFFFAOYSA-N
Compound name
6-bromo-1-(6-bromo-2-hydroxynaphthalen-1-yl)naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

1583
Patents

441.9204 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 442.92768 174.2
[M+Na]+ 464.90962 172.6
[M+NH4]+ 459.95422 176.9
[M+K]+ 480.88356 176.7
[M-H]- 440.91312 177.3
[M+Na-2H]- 462.89507 177.0
[M]+ 441.91985 174.1
[M]- 441.92095 174.1
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