CID 5479192

3'-az-seco-ribo-ddt

Structural Information

Molecular Formula
C10H15N5O5
SMILES
CC1=CN(C(=O)NC1=O)[C@@H](CO)O[C@@H](CN=[N+]=[N-])CO
InChI
InChI=1S/C10H15N5O5/c1-6-3-15(10(19)13-9(6)18)8(5-17)20-7(4-16)2-12-14-11/h3,7-8,16-17H,2,4-5H2,1H3,(H,13,18,19)/t7-,8+/m0/s1
InChIKey
LUEUKRBHHUYOEY-JGVFFNPUSA-N
Compound name
1-[(1R)-1-[(2S)-1-azido-3-hydroxypropan-2-yl]oxy-2-hydroxyethyl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.10733 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.11461 157.8
[M+Na]+ 308.09655 164.0
[M-H]- 284.10005 158.1
[M+NH4]+ 303.14115 168.9
[M+K]+ 324.07049 157.0
[M+H-H2O]+ 268.10459 154.0
[M+HCOO]- 330.10553 181.2
[M+CH3COO]- 344.12118 195.6
[M+Na-2H]- 306.08200 164.7
[M]+ 285.10678 156.5
[M]- 285.10788 156.5
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.