CID 54219070

187100-24-9

Structural Information

Molecular Formula
C6H12N4O4
SMILES
C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)N)O)O)O)N=[N+]=[N-]
InChI
InChI=1S/C6H12N4O4/c7-6-5(13)4(12)3(11)2(14-6)1-9-10-8/h2-6,11-13H,1,7H2/t2-,3-,4+,5-,6-/m1/s1
InChIKey
QBFXJUQJKLBFTK-VFUOTHLCSA-N
Compound name
(2R,3R,4S,5S,6R)-2-amino-6-(azidomethyl)oxane-3,4,5-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

204.08586 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.09314 140.5
[M+Na]+ 227.07508 148.4
[M+NH4]+ 222.11968 146.3
[M+K]+ 243.04902 148.0
[M-H]- 203.07858 144.2
[M+Na-2H]- 225.06053 142.0
[M]+ 204.08531 141.9
[M]- 204.08641 141.9
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

patents stripe