CID 465609

3-[(meoeto)me]azt

Structural Information

Molecular Formula
C14H21N5O6
SMILES
CC1=CN(C(=O)N(C1=O)COCCOC)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]
InChI
InChI=1S/C14H21N5O6/c1-9-6-18(12-5-10(16-17-15)11(7-20)25-12)14(22)19(13(9)21)8-24-4-3-23-2/h6,10-12,20H,3-5,7-8H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey
ABDWYVYEQSWHSG-QJPTWQEYSA-N
Compound name
1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-3-(2-methoxyethoxymethyl)-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

355.14917 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.15645 180.0
[M+Na]+ 378.13839 186.9
[M-H]- 354.14189 186.7
[M+NH4]+ 373.18299 190.2
[M+K]+ 394.11233 180.9
[M+H-H2O]+ 338.14643 174.9
[M+HCOO]- 400.14737 205.0
[M+CH3COO]- 414.16302 214.0
[M+Na-2H]- 376.12384 185.4
[M]+ 355.14862 183.3
[M]- 355.14972 183.3
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.