CID 25310

6-deoxy-l-mannopyranose

Structural Information

Molecular Formula
C6H12O5
SMILES
C[C@H]1[C@@H]([C@H]([C@H](C(O1)O)O)O)O
InChI
InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5+,6?/m0/s1
InChIKey
SHZGCJCMOBCMKK-JFNONXLTSA-N
Compound name
(3R,4R,5R,6S)-6-methyloxane-2,3,4,5-tetrol
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

7980
References

131747
Patents

164.06847 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.07575 132.2
[M+Na]+ 187.05769 139.6
[M-H]- 163.06119 131.6
[M+NH4]+ 182.10229 149.4
[M+K]+ 203.03163 139.0
[M+H-H2O]+ 147.06573 128.1
[M+HCOO]- 209.06667 147.4
[M+CH3COO]- 223.08232 168.9
[M+Na-2H]- 185.04314 135.4
[M]+ 164.06792 128.8
[M]- 164.06902 128.8
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.