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
cis-(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]+ 185.153606 143.0
[M+Na]+ 207.135548 145.2
[M-H]- 183.139054 147.3
[M+NH4]+ 202.180153 160.2
[M+K]+ 223.109488 144.5
[M+H-H2O]+ 167.143590 136.5
[M+HCOO]- 229.144531 157.7
[M+CH3COO]- 243.160181 177.7
[M+Na-2H]- 205.120996 146.4
[M]+ 184.14578142 134.4
[M]- 184.14687858 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.