CID 6398346

Azu-hp

Structural Information

Molecular Formula
C9H11N5O6P
SMILES
C1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)CO[P+](=O)O)N=[N+]=[N-]
InChI
InChI=1S/C9H10N5O6P/c10-13-12-5-3-8(20-6(5)4-19-21(17)18)14-2-1-7(15)11-9(14)16/h1-2,5-6,8H,3-4H2,(H-,11,15,16,17,18)/p+1/t5-,6+,8+/m0/s1
InChIKey
YGFFSJCGTILTSW-SHYZEUOFSA-O
Compound name
[(2S,3S,5R)-3-azido-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxy-oxophosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.0447 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.05198 160.6
[M+Na]+ 339.03392 166.0
[M-H]- 315.03742 165.2
[M+NH4]+ 334.07852 171.0
[M+K]+ 355.00786 155.1
[M+H-H2O]+ 299.04196 156.7
[M+HCOO]- 361.04290 189.2
[M+CH3COO]- 375.05855 193.2
[M+Na-2H]- 337.01937 168.9
[M]+ 316.04415 157.5
[M]- 316.04525 157.5
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.