CID 453641

4'-azd4t

Structural Information

Molecular Formula
C10H11N5O4
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C=C[C@](O2)(CO)N=[N+]=[N-]
InChI
InChI=1S/C10H11N5O4/c1-6-4-15(9(18)12-8(6)17)7-2-3-10(5-16,19-7)13-14-11/h2-4,7,16H,5H2,1H3,(H,12,17,18)/t7-,10+/m1/s1
InChIKey
LBKOJHCKIMQJPQ-XCBNKYQSSA-N
Compound name
1-[(2R,5S)-5-azido-5-(hydroxymethyl)-2H-furan-2-yl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

265.08112 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.08840 152.1
[M+Na]+ 288.07034 161.2
[M-H]- 264.07384 158.2
[M+NH4]+ 283.11494 167.2
[M+K]+ 304.04428 154.2
[M+H-H2O]+ 248.07838 148.8
[M+HCOO]- 310.07932 178.4
[M+CH3COO]- 324.09497 191.3
[M+Na-2H]- 286.05579 162.3
[M]+ 265.08057 150.7
[M]- 265.08167 150.7
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.