CID 13361

Refchem:929181

Structural Information

Molecular Formula
C2H7O3P
SMILES
COP(=O)OC
InChI
InChI=1S/C2H7O3P/c1-4-6(3)5-2/h6H,1-2H3
InChIKey
HZCDANOFLILNSA-UHFFFAOYSA-N
Compound name
methoxyphosphonoyloxymethane
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

26
References

0
Patents

110.01328 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.020556 118.4
[M+Na]+ 133.002498 126.9
[M-H]- 109.006004 118.2
[M+NH4]+ 128.047103 142.0
[M+K]+ 148.976438 128.8
[M+H-H2O]+ 93.010540 112.2
[M+HCOO]- 155.011481 148.6
[M+CH3COO]- 169.027131 168.0
[M+Na-2H]- 130.987946 122.7
[M]+ 110.01273142 123.0
[M]- 110.01382858 123.0
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.