CID 170454650

[(2r,3s)-3-(hydroxymethyl)oxiran-2-yl]phosphonic acid

Structural Information

Molecular Formula
C3H7O5P
SMILES
C([C@H]1[C@H](O1)P(=O)(O)O)O
InChI
InChI=1S/C3H7O5P/c4-1-2-3(8-2)9(5,6)7/h2-4H,1H2,(H2,5,6,7)/t2-,3+/m0/s1
InChIKey
GPEGORIFKQJSOQ-STHAYSLISA-N
Compound name
[(2R,3S)-3-(hydroxymethyl)oxiran-2-yl]phosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.00311 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.010386 129.5
[M+Na]+ 176.992328 139.5
[M-H]- 152.995834 130.5
[M+NH4]+ 172.036933 143.3
[M+K]+ 192.966268 138.2
[M+H-H2O]+ 137.000370 122.8
[M+HCOO]- 199.001311 153.5
[M+CH3COO]- 213.016961 170.5
[M+Na-2H]- 174.977776 134.9
[M]+ 154.00256142 133.9
[M]- 154.00365858 133.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.