CID 3450796

Cyclohexyl(dicyclopropyl)methanol

Structural Information

Molecular Formula
C13H22O
SMILES
C1CCC(CC1)C(C2CC2)(C3CC3)O
InChI
InChI=1S/C13H22O/c14-13(11-6-7-11,12-8-9-12)10-4-2-1-3-5-10/h10-12,14H,1-9H2
InChIKey
JGIFCDXLSBRZQP-UHFFFAOYSA-N
Compound name
cyclohexyl(dicyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.16707 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.17435 148.6
[M+Na]+ 217.15629 152.5
[M-H]- 193.15979 155.9
[M+NH4]+ 212.20089 155.8
[M+K]+ 233.13023 151.4
[M+H-H2O]+ 177.16433 142.7
[M+HCOO]- 239.16527 163.5
[M+CH3COO]- 253.18092 194.1
[M+Na-2H]- 215.14174 151.4
[M]+ 194.16652 146.8
[M]- 194.16762 146.8
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.