CID 53981988

Undeca-1,5-dien-3-ol

Structural Information

Molecular Formula
C11H20O
SMILES
CCCCCC=CCC(C=C)O
InChI
InChI=1S/C11H20O/c1-3-5-6-7-8-9-10-11(12)4-2/h4,8-9,11-12H,2-3,5-7,10H2,1H3
InChIKey
JYWXEBALSPBIIA-UHFFFAOYSA-N
Compound name
undeca-1,5-dien-3-ol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

10
Patents

168.15141 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.158686 143.1
[M+Na]+ 191.140628 148.3
[M-H]- 167.144134 141.3
[M+NH4]+ 186.185233 163.1
[M+K]+ 207.114568 145.6
[M+H-H2O]+ 151.148670 138.3
[M+HCOO]- 213.149611 163.4
[M+CH3COO]- 227.165261 180.0
[M+Na-2H]- 189.126076 145.8
[M]+ 168.15086142 143.7
[M]- 168.15195858 143.7
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

patents stripe