CID 451579

4-hazt

Structural Information

Molecular Formula
C10H13N5O3
SMILES
CC1=CN(C(=O)N=C1)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]
InChI
InChI=1S/C10H13N5O3/c1-6-3-12-10(17)15(4-6)9-2-7(13-14-11)8(5-16)18-9/h3-4,7-9,16H,2,5H2,1H3/t7-,8+,9+/m0/s1
InChIKey
CRDRWKSYEXVRGH-DJLDLDEBSA-N
Compound name
1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

251.10184 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.10912 153.9
[M+Na]+ 274.09106 161.5
[M-H]- 250.09456 160.6
[M+NH4]+ 269.13566 168.3
[M+K]+ 290.06500 155.2
[M+H-H2O]+ 234.09910 149.6
[M+HCOO]- 296.10004 179.8
[M+CH3COO]- 310.11569 193.4
[M+Na-2H]- 272.07651 161.8
[M]+ 251.10129 151.9
[M]- 251.10239 151.9
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.