CID 50986253

Hp-ep

Structural Information

Molecular Formula
C2H8O8P2
SMILES
C(C(O)P(=O)(O)O)OP(=O)(O)O
InChI
InChI=1S/C2H8O8P2/c3-2(11(4,5)6)1-10-12(7,8)9/h2-3H,1H2,(H2,4,5,6)(H2,7,8,9)
InChIKey
UCAULRBMUYBLIK-UHFFFAOYSA-N
Compound name
(1-hydroxy-2-phosphonooxyethyl)phosphonic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

221.96944 Da
Monoisotopic Mass

-3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.97672 145.8
[M+Na]+ 244.95866 151.5
[M-H]- 220.96216 137.2
[M+NH4]+ 240.00326 160.9
[M+K]+ 260.93260 151.8
[M+H-H2O]+ 204.96670 137.7
[M+HCOO]- 266.96764 171.1
[M+CH3COO]- 280.98329 174.0
[M+Na-2H]- 242.94411 147.9
[M]+ 221.96889 147.1
[M]- 221.96999 147.1
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.