CID 428902

Seleninic acid, propyl-

Structural Information

Molecular Formula
C3H8O2Se
SMILES
CCC[Se](=O)O
InChI
InChI=1S/C3H8O2Se/c1-2-3-6(4)5/h2-3H2,1H3,(H,4,5)
InChIKey
PEDKRBWGEAUUKD-UHFFFAOYSA-N
Compound name
propane-1-seleninic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.96895 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.97623 127.9
[M+Na]+ 178.95817 135.1
[M-H]- 154.96167 126.7
[M+NH4]+ 174.00277 150.4
[M+K]+ 194.93211 135.0
[M+H-H2O]+ 138.96621 123.4
[M+HCOO]- 200.96715 149.8
[M+CH3COO]- 214.98280 164.6
[M+Na-2H]- 176.94362 133.0
[M]+ 155.96840 128.1
[M]- 155.96950 128.1
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

No patent data available for this compound.