CID 21155950

7-octen-3-ol, 2,2-dimethyl-5-methylene-

Structural Information

Molecular Formula
C11H20O
SMILES
CC(C)(C)C(CC(=C)CC=C)O
InChI
InChI=1S/C11H20O/c1-6-7-9(2)8-10(12)11(3,4)5/h6,10,12H,1-2,7-8H2,3-5H3
InChIKey
DKRSOEZYLGQVDF-UHFFFAOYSA-N
Compound name
2,2-dimethyl-5-methylideneoct-7-en-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.15141 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.158686 141.9
[M+Na]+ 191.140628 147.4
[M-H]- 167.144134 140.6
[M+NH4]+ 186.185233 162.0
[M+K]+ 207.114568 145.6
[M+H-H2O]+ 151.148670 138.0
[M+HCOO]- 213.149611 159.8
[M+CH3COO]- 227.165261 181.1
[M+Na-2H]- 189.126076 144.2
[M]+ 168.15086142 141.4
[M]- 168.15195858 141.4
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.