CID 95955

Dibenzyl diselenide

Structural Information

Molecular Formula
C14H14Se2
SMILES
C1=CC=C(C=C1)C[Se][Se]CC2=CC=CC=C2
InChI
InChI=1S/C14H14Se2/c1-3-7-13(8-4-1)11-15-16-12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey
HYAVEDMFTNAZQE-UHFFFAOYSA-N
Compound name
(benzyldiselanyl)methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

473
Patents

341.9426 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.94988 172.9
[M+Na]+ 364.93182 177.7
[M-H]- 340.93532 177.7
[M+NH4]+ 359.97642 189.9
[M+K]+ 380.90576 172.6
[M+H-H2O]+ 324.93986 163.9
[M+HCOO]- 386.94080 195.2
[M+CH3COO]- 400.95645 192.9
[M+Na-2H]- 362.91727 177.3
[M]+ 341.94205 172.5
[M]- 341.94315 172.5
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