CID 134814677

1-butanol, 4-cyclohexylidene-3-methyl-

Structural Information

Molecular Formula
C11H20O
SMILES
CC(CCO)C=C1CCCCC1
InChI
InChI=1S/C11H20O/c1-10(7-8-12)9-11-5-3-2-4-6-11/h9-10,12H,2-8H2,1H3
InChIKey
PLUVPUJEUHOMDC-UHFFFAOYSA-N
Compound name
4-cyclohexylidene-3-methylbutan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

168.15141 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.158686 142.1
[M+Na]+ 191.140628 145.2
[M-H]- 167.144134 142.9
[M+NH4]+ 186.185233 161.6
[M+K]+ 207.114568 143.0
[M+H-H2O]+ 151.148670 136.6
[M+HCOO]- 213.149611 159.5
[M+CH3COO]- 227.165261 177.2
[M+Na-2H]- 189.126076 144.4
[M]+ 168.15086142 136.5
[M]- 168.15195858 136.5
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.