CID 131752784

6-o-b-d-fructofuranosyl-2-deoxy-d-glucose

Structural Information

Molecular Formula
C12H22O10
SMILES
C1C(C(C(OC1O)COC2(C(C(C(O2)CO)O)O)CO)O)O
InChI
InChI=1S/C12H22O10/c13-2-6-10(18)11(19)12(4-14,22-6)20-3-7-9(17)5(15)1-8(16)21-7/h5-11,13-19H,1-4H2
InChIKey
SMVQCONTAPZYQB-UHFFFAOYSA-N
Compound name
6-[[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxymethyl]oxane-2,4,5-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

326.1213 Da
Monoisotopic Mass

-3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.12858 168.3
[M+Na]+ 349.11052 172.4
[M-H]- 325.11402 166.9
[M+NH4]+ 344.15512 178.7
[M+K]+ 365.08446 172.6
[M+H-H2O]+ 309.11856 164.5
[M+HCOO]- 371.11950 175.8
[M+CH3COO]- 385.13515 193.1
[M+Na-2H]- 347.09597 168.1
[M]+ 326.12075 166.7
[M]- 326.12185 166.7
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