CID 3055064

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

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]+ 303.180216 165.1
[M+Na]+ 325.162158 172.6
[M-H]- 301.165664 175.3
[M+NH4]+ 320.206763 183.8
[M+K]+ 341.136098 176.6
[M+H-H2O]+ 285.170200 165.8
[M+HCOO]- 347.171141 179.9
[M+CH3COO]- 361.186791 203.4
[M+Na-2H]- 323.147606 168.2
[M]+ 302.17239142 172.5
[M]- 302.17348858 172.5
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.