CID 121288738

Foscarbidopa

Structural Information

Molecular Formula
C10H15N2O7P
SMILES
C[C@](CC1=CC(=C(C=C1)OP(=O)(O)O)O)(C(=O)O)NN
InChI
InChI=1S/C10H15N2O7P/c1-10(12-11,9(14)15)5-6-2-3-8(7(13)4-6)19-20(16,17)18/h2-4,12-13H,5,11H2,1H3,(H,14,15)(H2,16,17,18)/t10-/m0/s1
InChIKey
PQUZXFMHVSMUNG-JTQLQIEISA-N
Compound name
(2S)-2-hydrazinyl-3-(3-hydroxy-4-phosphonooxyphenyl)-2-methylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

101
Patents

306.06168 Da
Monoisotopic Mass

-5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.06896 165.1
[M+Na]+ 329.05090 169.4
[M-H]- 305.05440 161.8
[M+NH4]+ 324.09550 176.3
[M+K]+ 345.02484 168.5
[M+H-H2O]+ 289.05894 156.9
[M+HCOO]- 351.05988 186.9
[M+CH3COO]- 365.07553 199.7
[M+Na-2H]- 327.03635 167.1
[M]+ 306.06113 163.8
[M]- 306.06223 163.8
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

patents stripe