CID 120085

28897-20-3

Structural Information

Molecular Formula
C13H22O
SMILES
CC(=CCCC(=CC(CC=C)O)C)C
InChI
InChI=1S/C13H22O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,10,13-14H,1,6-7,9H2,2-4H3
InChIKey
BGAGVDYLLDRYCL-UHFFFAOYSA-N
Compound name
6,10-dimethylundeca-1,5,9-trien-4-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

15
Patents

194.16707 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.17435 151.6
[M+Na]+ 217.15629 159.9
[M+NH4]+ 212.20089 157.8
[M+K]+ 233.13023 154.2
[M-H]- 193.15979 149.6
[M+Na-2H]- 215.14174 152.4
[M]+ 194.16652 151.8
[M]- 194.16762 151.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe