CID 473795

F-aztmp

Structural Information

Molecular Formula
C10H13FN5O6P
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)F)N=[N+]=[N-]
InChI
InChI=1S/C10H13FN5O6P/c1-5-3-16(10(18)13-9(5)17)8-2-6(14-15-12)7(22-8)4-21-23(11,19)20/h3,6-8H,2,4H2,1H3,(H,19,20)(H,13,17,18)/t6-,7+,8+/m0/s1
InChIKey
SMOCPMVULMGVPP-XLPZGREQSA-N
Compound name
[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-fluorophosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

349.05875 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.06603 168.5
[M+Na]+ 372.04797 175.4
[M-H]- 348.05147 172.0
[M+NH4]+ 367.09257 178.5
[M+K]+ 388.02191 169.4
[M+H-H2O]+ 332.05601 161.7
[M+HCOO]- 394.05695 196.0
[M+CH3COO]- 408.07260 207.0
[M+Na-2H]- 370.03342 174.9
[M]+ 349.05820 166.6
[M]- 349.05930 166.6
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

No patent data available for this compound.