CID 45479325

Deamino alpha-keto demethylphosphinothricin

Structural Information

Molecular Formula
C4H5O5P
SMILES
C(CP(=O)=O)C(=O)C(=O)O
InChI
InChI=1S/C4H5O5P/c5-3(4(6)7)1-2-10(8)9/h1-2H2,(H,6,7)
InChIKey
AKMINQWXCPCNPK-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1
Patents

163.98746 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.99474 128.6
[M+Na]+ 186.97668 136.1
[M-H]- 162.98018 126.7
[M+NH4]+ 182.02128 148.6
[M+K]+ 202.95062 136.6
[M+H-H2O]+ 146.98472 122.0
[M+HCOO]- 208.98566 155.7
[M+CH3COO]- 223.00131 174.3
[M+Na-2H]- 184.96213 129.1
[M]+ 163.98691 131.4
[M]- 163.98801 131.4
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

patents stripe