CID 97182181

(2-azidoethyl)-2-acetamido-alpha-d-glucopyranoside

Structural Information

Molecular Formula
C10H18N4O6
SMILES
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OCCN=[N+]=[N-])CO)O)O
InChI
InChI=1S/C10H18N4O6/c1-5(16)13-7-9(18)8(17)6(4-15)20-10(7)19-3-2-12-14-11/h6-10,15,17-18H,2-4H2,1H3,(H,13,16)/t6-,7-,8-,9-,10+/m1/s1
InChIKey
DHQJPCIPZHPDSL-IGORNWKESA-N
Compound name
N-[(2S,3R,4R,5S,6R)-2-(2-azidoethoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.12262 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.12990 161.1
[M+Na]+ 313.11184 164.4
[M-H]- 289.11534 163.5
[M+NH4]+ 308.15644 173.0
[M+K]+ 329.08578 159.8
[M+H-H2O]+ 273.11988 158.2
[M+HCOO]- 335.12082 183.5
[M+CH3COO]- 349.13647 199.8
[M+Na-2H]- 311.09729 166.6
[M]+ 290.12207 157.7
[M]- 290.12317 157.7
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.