CID 477344

C-d4-oxanosine

Structural Information

Molecular Formula
C11H12N4O3
SMILES
C1[C@@H](C=C[C@@H]1N2C=NC3=C2N=C(OC3=O)N)CO
InChI
InChI=1S/C11H12N4O3/c12-11-14-9-8(10(17)18-11)13-5-15(9)7-2-1-6(3-7)4-16/h1-2,5-7,16H,3-4H2,(H2,12,14)/t6-,7+/m1/s1
InChIKey
HAMPGWVEAMHFJW-RQJHMYQMSA-N
Compound name
5-amino-3-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]imidazo[4,5-d][1,3]oxazin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

248.09094 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.09822 151.2
[M+Na]+ 271.08016 162.7
[M-H]- 247.08366 155.7
[M+NH4]+ 266.12476 167.0
[M+K]+ 287.05410 159.6
[M+H-H2O]+ 231.08820 143.6
[M+HCOO]- 293.08914 172.8
[M+CH3COO]- 307.10479 164.2
[M+Na-2H]- 269.06561 155.1
[M]+ 248.09039 153.6
[M]- 248.09149 153.6
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.