CID 11789291

2-(prop-2-en-1-yl)cyclohexan-1-ol

Structural Information

Molecular Formula
C9H16O
SMILES
C=CCC1CCCCC1O
InChI
InChI=1S/C9H16O/c1-2-5-8-6-3-4-7-9(8)10/h2,8-10H,1,3-7H2
InChIKey
SBIOKFOCGZXJME-UHFFFAOYSA-N
Compound name
2-prop-2-enylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

85
Patents

140.12012 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.12740 131.7
[M+Na]+ 163.10934 136.8
[M-H]- 139.11284 133.2
[M+NH4]+ 158.15394 152.6
[M+K]+ 179.08328 134.6
[M+H-H2O]+ 123.11738 126.7
[M+HCOO]- 185.11832 150.8
[M+CH3COO]- 199.13397 172.0
[M+Na-2H]- 161.09479 135.8
[M]+ 140.11957 126.5
[M]- 140.12067 126.5
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.