CID 362383

Nsc626152

Structural Information

Molecular Formula
C16H10O3Se2
SMILES
C1=CC=C(C=C1)[Se]C2=C(C(=O)OC2=O)[Se]C3=CC=CC=C3
InChI
InChI=1S/C16H10O3Se2/c17-15-13(20-11-7-3-1-4-8-11)14(16(18)19-15)21-12-9-5-2-6-10-12/h1-10H
InChIKey
QNAWHENTNHXXSX-UHFFFAOYSA-N
Compound name
3,4-bis(phenylselanyl)furan-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.89603 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.90331 186.2
[M+Na]+ 432.88525 193.6
[M-H]- 408.88875 196.0
[M+NH4]+ 427.92985 201.0
[M+K]+ 448.85919 189.4
[M+H-H2O]+ 392.89329 177.1
[M+HCOO]- 454.89423 208.6
[M+CH3COO]- 468.90988 202.7
[M+Na-2H]- 430.87070 186.9
[M]+ 409.89548 187.9
[M]- 409.89658 187.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.