CID 511851

Bis[2-(1-imidazoylacyl)phenyl diselenide

Structural Information

Molecular Formula
C20H14N4O2Se2
SMILES
C1=CC=C(C(=C1)C(=O)N2C=CN=C2)[Se][Se]C3=CC=CC=C3C(=O)N4C=CN=C4
InChI
InChI=1S/C20H14N4O2Se2/c25-19(23-11-9-21-13-23)15-5-1-3-7-17(15)27-28-18-8-4-2-6-16(18)20(26)24-12-10-22-14-24/h1-14H
InChIKey
GNKQMLDCAUHEKC-UHFFFAOYSA-N
Compound name
[2-[[2-(imidazole-1-carbonyl)phenyl]diselanyl]phenyl]-imidazol-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

501.94473 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 502.95201 209.6
[M+Na]+ 524.93395 216.2
[M-H]- 500.93745 217.2
[M+NH4]+ 519.97855 217.3
[M+K]+ 540.90789 209.5
[M+H-H2O]+ 484.94199 196.2
[M+HCOO]- 546.94293 228.6
[M+CH3COO]- 560.95858 217.5
[M+Na-2H]- 522.91940 207.0
[M]+ 501.94418 211.6
[M]- 501.94528 211.6
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.