CID 6334739

D4c-hp

Structural Information

Molecular Formula
C9H11N3O5P
SMILES
C1=C[C@@H](O[C@@H]1CO[P+](=O)O)N2C=CC(=NC2=O)N
InChI
InChI=1S/C9H10N3O5P/c10-7-3-4-12(9(13)11-7)8-2-1-6(17-8)5-16-18(14)15/h1-4,6,8H,5H2,(H2-,10,11,13,14,15)/p+1/t6-,8+/m0/s1
InChIKey
FXSCYHIWKVIARP-POYBYMJQSA-O
Compound name
[(2S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methoxy-hydroxy-oxophosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.04364 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.05092 155.2
[M+Na]+ 295.03286 162.6
[M-H]- 271.03636 158.1
[M+NH4]+ 290.07746 167.9
[M+K]+ 311.00680 156.5
[M+H-H2O]+ 255.04090 147.5
[M+HCOO]- 317.04184 180.8
[M+CH3COO]- 331.05749 187.6
[M+Na-2H]- 293.01831 158.3
[M]+ 272.04309 155.4
[M]- 272.04419 155.4
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

No patent data available for this compound.