CID 21145406

3,6-anhydro-l-galactose

Structural Information

Molecular Formula
C6H10O5
SMILES
C1[C@@H]([C@H]([C@@H](O1)[C@@H](C=O)O)O)O
InChI
InChI=1S/C6H10O5/c7-1-3(8)6-5(10)4(9)2-11-6/h1,3-6,8-10H,2H2/t3-,4+,5-,6+/m1/s1
InChIKey
WZYRMLAWNVOIEX-MOJAZDJTSA-N
Compound name
(2S)-2-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetaldehyde
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

2
References

2518
Patents

162.05283 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.06011 131.6
[M+Na]+ 185.04205 139.0
[M+NH4]+ 180.08665 137.4
[M+K]+ 201.01599 139.4
[M-H]- 161.04555 130.5
[M+Na-2H]- 183.02750 131.8
[M]+ 162.05228 131.8
[M]- 162.05338 131.8
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

patents stripe