CID 25087143

Dtxsid20930638

Structural Information

Molecular Formula
O
SMILES
[15O]
InChI
InChI=1S/O/i1-1
InChIKey
QVGXLLKOCUKJST-BJUDXGSMSA-N
Compound name
oxidane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

4561
References

109
Patents

15.003066 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 16.010342 95.0
[M+Na]+ 37.992284 103.9
[M-H]- 13.995790 95.9
[M+NH4]+ 33.036889 121.6
[M+K]+ 53.966224 106.0
[M+H-H2O]+ -1.999674 91.3
[M+HCOO]- 60.001267 121.5
[M+CH3COO]- 74.016917 150.2
[M+Na-2H]- 35.977732 106.3
[M]+ 15.00251742 95.7
[M]- 15.00361458 95.7
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.