CID 49867457

Ns00072818

Structural Information

Molecular Formula
C3H7O4P
SMILES
C(CO)COP(=O)=O
InChI
InChI=1S/C3H7O4P/c4-2-1-3-7-8(5)6/h4H,1-3H2
InChIKey
ARGGXLVXBNBKMN-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.0082 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.01548 125.2
[M+Na]+ 160.99742 133.0
[M-H]- 137.00092 123.3
[M+NH4]+ 156.04202 146.7
[M+K]+ 176.97136 133.5
[M+H-H2O]+ 121.00546 118.7
[M+HCOO]- 183.00640 154.0
[M+CH3COO]- 197.02205 169.4
[M+Na-2H]- 158.98287 128.5
[M]+ 138.00765 128.9
[M]- 138.00875 128.9
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.