CID 11159301

(ethylphosphonoyl)ethane

Structural Information

Molecular Formula
C4H10OP
SMILES
CC[P+](=O)CC
InChI
InChI=1S/C4H10OP/c1-3-6(5)4-2/h3-4H2,1-2H3/q+1
InChIKey
YVXVNGVYXSQARS-UHFFFAOYSA-N
Compound name
diethyl(oxo)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

1721
Patents

105.04693 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.05421 121.7
[M+Na]+ 128.03615 129.7
[M-H]- 104.03965 121.7
[M+NH4]+ 123.08075 145.4
[M+K]+ 144.01009 124.9
[M+H-H2O]+ 88.044190 118.6
[M+HCOO]- 150.04513 150.6
[M+CH3COO]- 164.06078 163.3
[M+Na-2H]- 126.02160 127.4
[M]+ 105.04638 122.9
[M]- 105.04748 122.9
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