CID 15480632

1-[(2r,3r,4s)-3-azido-4-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione

Structural Information

Molecular Formula
C10H13N5O4
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@H](CO2)CO)N=[N+]=[N-]
InChI
InChI=1S/C10H13N5O4/c1-5-2-15(10(18)12-8(5)17)9-7(13-14-11)6(3-16)4-19-9/h2,6-7,9,16H,3-4H2,1H3,(H,12,17,18)/t6-,7+,9+/m0/s1
InChIKey
FMUNPLMWHOKDSD-LKEWCRSYSA-N
Compound name
1-[(2R,3R,4S)-3-azido-4-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.09674 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.104016 156.6
[M+Na]+ 290.085958 164.6
[M-H]- 266.089464 162.3
[M+NH4]+ 285.130563 169.7
[M+K]+ 306.059898 157.4
[M+H-H2O]+ 250.094000 152.6
[M+HCOO]- 312.094941 181.3
[M+CH3COO]- 326.110591 193.5
[M+Na-2H]- 288.071406 163.6
[M]+ 267.09619142 153.8
[M]- 267.09728858 153.8
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.