CID 3055064

1:2,5:6-di-o-isopropylidene-3-o-propyl-alpha-d-glucofuranose

Structural Information

Molecular Formula
C15H26O6
SMILES
CCCO[C@H]1[C@H](OC2C1OC(O2)(C)C)[C@H]3COC(O3)(C)C
InChI
InChI=1S/C15H26O6/c1-6-7-16-11-10(9-8-17-14(2,3)19-9)18-13-12(11)20-15(4,5)21-13/h9-13H,6-8H2,1-5H3/t9-,10-,11+,12?,13?/m1/s1
InChIKey
WHYCYJUAIQNWPT-VFPQWFPESA-N
Compound name
(5R,6S)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6-propoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.17294 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.18022 162.9
[M+Na]+ 325.16216 170.5
[M+NH4]+ 320.20676 172.1
[M+K]+ 341.13610 170.7
[M-H]- 301.16566 169.8
[M+Na-2H]- 323.14761 163.4
[M]+ 302.17239 166.1
[M]- 302.17349 166.1
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.