CID 129654212

Binaphthyl diselenide

Structural Information

Molecular Formula
C20H14Se2
SMILES
C1=CC=C2C(=C1)C=CC=C2C34C([Se]3)C5C([Se]5)C6=CC=CC=C46
InChI
InChI=1S/C20H14Se2/c1-2-8-13-12(6-1)7-5-11-15(13)20-16-10-4-3-9-14(16)17-18(21-17)19(20)22-20/h1-11,17-19H
InChIKey
NVCYZYYHSVXONX-UHFFFAOYSA-N
Compound name
2-naphthalen-1-yl-3,6-diselenatetracyclo[6.4.0.02,4.05,7]dodeca-1(12),8,10-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

413.9426 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 414.94988 190.6
[M+Na]+ 436.93182 198.7
[M-H]- 412.93532 198.2
[M+NH4]+ 431.97642 199.1
[M+K]+ 452.90576 194.4
[M+H-H2O]+ 396.93986 181.7
[M+HCOO]- 458.94080 203.8
[M+CH3COO]- 472.95645 197.8
[M+Na-2H]- 434.91727 194.5
[M]+ 413.94205 193.1
[M]- 413.94315 193.1
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

No patent data available for this compound.