CID 5460480

Diastatine

Structural Information

Molecular Formula
At2
SMILES
[At][At]
InChI
InChI=1S/At2/c1-2
InChIKey
BSXAZQBJJWCDAY-UHFFFAOYSA-N
Compound name
astatanylastatine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

378
References

113
Patents

419.9743 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.98158 178.3
[M+Na]+ 442.96352 184.0
[M-H]- 418.96702 176.3
[M+NH4]+ 438.00812 200.4
[M+K]+ 458.93746 182.7
[M+H-H2O]+ 402.97156 171.0
[M+HCOO]- 464.97250 199.0
[M+CH3COO]- 478.98815 171.7
[M+Na-2H]- 440.94897 179.4
[M]+ 419.97375 178.5
[M]- 419.97485 178.5
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