CID 147689783

Rac-(1r,2s)-2-(oxan-4-yl)cyclohexan-1-ol

Structural Information

Molecular Formula
C11H20O2
SMILES
C1CC[C@H]([C@@H](C1)C2CCOCC2)O
InChI
InChI=1S/C11H20O2/c12-11-4-2-1-3-10(11)9-5-7-13-8-6-9/h9-12H,1-8H2/t10-,11+/m0/s1
InChIKey
GQSXCDAJYINAQJ-WDEREUQCSA-N
Compound name
(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.14633 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.15361 143.0
[M+Na]+ 207.13555 145.2
[M-H]- 183.13905 147.3
[M+NH4]+ 202.18015 160.2
[M+K]+ 223.10949 144.5
[M+H-H2O]+ 167.14359 136.5
[M+HCOO]- 229.14453 157.7
[M+CH3COO]- 243.16018 177.7
[M+Na-2H]- 205.12100 146.4
[M]+ 184.14578 134.4
[M]- 184.14688 134.4
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.