CID 85160302

Trans-p-menthane-7,8-diol 8-glucoside

Structural Information

Molecular Formula
C16H30O7
SMILES
CC(C)(C1CCC(CC1)CO)OC2C(C(C(C(O2)CO)O)O)O
InChI
InChI=1S/C16H30O7/c1-16(2,10-5-3-9(7-17)4-6-10)23-15-14(21)13(20)12(19)11(8-18)22-15/h9-15,17-21H,3-8H2,1-2H3
InChIKey
KMNHZNJPIOZBEM-UHFFFAOYSA-N
Compound name
2-(hydroxymethyl)-6-[2-[4-(hydroxymethyl)cyclohexyl]propan-2-yloxy]oxane-3,4,5-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.19916 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.20644 177.1
[M+Na]+ 357.18838 182.6
[M+NH4]+ 352.23298 180.8
[M+K]+ 373.16232 181.8
[M-H]- 333.19188 176.7
[M+Na-2H]- 355.17383 175.3
[M]+ 334.19861 177.1
[M]- 334.19971 177.1
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.