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]+ 201.148526 145.6
[M+Na]+ 223.130468 149.7
[M-H]- 199.133974 151.1
[M+NH4]+ 218.175073 164.8
[M+K]+ 239.104408 150.5
[M+H-H2O]+ 183.138510 140.7
[M+HCOO]- 245.139451 161.7
[M+CH3COO]- 259.155101 179.1
[M+Na-2H]- 221.115916 149.7
[M]+ 200.14070142 141.6
[M]- 200.14179858 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.