CID 104770

Chlorate

Structural Information

Molecular Formula
ClO3
SMILES
[O-]Cl(=O)=O
InChI
InChI=1S/ClHO3/c2-1(3)4/h(H,2,3,4)/p-1
InChIKey
XTEGARKTQYYJKE-UHFFFAOYSA-M
Compound name
chlorate
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

920
References

118000
Patents

82.9536 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 83.960876 113.3
[M+Na]+ 105.94282 121.6
[M-H]- 81.946324 109.5
[M+NH4]+ 100.98742 134.5
[M+K]+ 121.91676 118.0
[M+H-H2O]+ 65.950860 120.5
[M+HCOO]- 127.95180 131.3
[M+CH3COO]- 141.96745 147.9
[M+Na-2H]- 103.92827 119.7
[M]+ 82.953051 109.8
[M]- 82.954149 109.8
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