CID 22845704

D-fructose, 6-azido-6-deoxy-

Structural Information

Molecular Formula
C6H11N3O5
SMILES
C([C@H]([C@H]([C@@H](C(=O)CO)O)O)O)N=[N+]=[N-]
InChI
InChI=1S/C6H11N3O5/c7-9-8-1-3(11)5(13)6(14)4(12)2-10/h3,5-6,10-11,13-14H,1-2H2/t3-,5-,6-/m1/s1
InChIKey
DHCFCMVDOWDQHL-UYFOZJQFSA-N
Compound name
(3S,4R,5R)-6-azido-1,3,4,5-tetrahydroxyhexan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

205.06987 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.07715 139.6
[M+Na]+ 228.05909 143.0
[M-H]- 204.06259 136.9
[M+NH4]+ 223.10369 155.2
[M+K]+ 244.03303 138.6
[M+H-H2O]+ 188.06713 138.4
[M+HCOO]- 250.06807 161.7
[M+CH3COO]- 264.08372 178.5
[M+Na-2H]- 226.04454 143.6
[M]+ 205.06932 134.7
[M]- 205.07042 134.7
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