CID 518605

Chebi:30621

Structural Information

Molecular Formula
As4O6
SMILES
O1[As]2O[As]3O[As]1O[As](O2)O3
InChI
InChI=1S/As4O6/c5-1-6-3-8-2(5)9-4(7-1)10-3
InChIKey
KTTMEOWBIWLMSE-UHFFFAOYSA-N
Compound name
2,4,6,8,9,10-hexaoxa-1,3,5,7-tetrarsatricyclo[3.3.1.13,7]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3378
References

6173
Patents

395.65588 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.66316 155.3
[M+Na]+ 418.64510 158.8
[M-H]- 394.64860 154.2
[M+NH4]+ 413.68970 171.1
[M+K]+ 434.61904 165.3
[M+H-H2O]+ 378.65314 148.2
[M+HCOO]- 440.65408 159.0
[M+CH3COO]- 454.66973 164.6
[M+Na-2H]- 416.63055 170.0
[M]+ 395.65533 163.6
[M]- 395.65643 163.6
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