CID 9815308

Disodium peroxydicarbonate

Structural Information

Molecular Formula
C2H2O6
SMILES
C(=O)(O)OOC(=O)O
InChI
InChI=1S/C2H2O6/c3-1(4)7-8-2(5)6/h(H,3,4)(H,5,6)
InChIKey
XYXGFHALMTXBQX-UHFFFAOYSA-N
Compound name
carboxyoxy hydrogen carbonate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

1
References

48126
Patents

121.98514 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.99242 116.0
[M+Na]+ 144.97436 124.1
[M-H]- 120.97786 114.3
[M+NH4]+ 140.01896 136.8
[M+K]+ 160.94830 125.7
[M+H-H2O]+ 104.98240 112.0
[M+HCOO]- 166.98334 138.0
[M+CH3COO]- 180.99899 160.0
[M+Na-2H]- 142.95981 121.8
[M]+ 121.98459 117.8
[M]- 121.98569 117.8
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