CID 21900

2-cyclohexyl-2-methyl-1,3-dioxolane-4-methanol

Structural Information

Molecular Formula
C11H20O3
SMILES
CC1(OCC(O1)CO)C2CCCCC2
InChI
InChI=1S/C11H20O3/c1-11(9-5-3-2-4-6-9)13-8-10(7-12)14-11/h9-10,12H,2-8H2,1H3
InChIKey
MNGGBXINICRUAP-UHFFFAOYSA-N
Compound name
(2-cyclohexyl-2-methyl-1,3-dioxolan-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.14125 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.14853 145.6
[M+Na]+ 223.13047 149.7
[M-H]- 199.13397 151.1
[M+NH4]+ 218.17507 164.8
[M+K]+ 239.10441 150.5
[M+H-H2O]+ 183.13851 140.7
[M+HCOO]- 245.13945 161.7
[M+CH3COO]- 259.15510 179.1
[M+Na-2H]- 221.11592 149.7
[M]+ 200.14070 141.6
[M]- 200.14180 141.6
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.