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]+ 169.15869 141.9
[M+Na]+ 191.14063 147.4
[M-H]- 167.14413 140.6
[M+NH4]+ 186.18523 162.0
[M+K]+ 207.11457 145.6
[M+H-H2O]+ 151.14867 138.0
[M+HCOO]- 213.14961 159.8
[M+CH3COO]- 227.16526 181.1
[M+Na-2H]- 189.12608 144.2
[M]+ 168.15086 141.4
[M]- 168.15196 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.