CID 91116

2,6,10-trimethylundeca-5,9-dienol

Structural Information

Molecular Formula
C14H26O
SMILES
CC(CCC=C(C)CCC=C(C)C)CO
InChI
InChI=1S/C14H26O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h7,9,14-15H,5-6,8,10-11H2,1-4H3
InChIKey
SVHDKVPXRARVAO-UHFFFAOYSA-N
Compound name
2,6,10-trimethylundeca-5,9-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2
References

71
Patents

210.19836 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.20564 157.6
[M+Na]+ 233.18758 161.2
[M-H]- 209.19108 155.4
[M+NH4]+ 228.23218 175.9
[M+K]+ 249.16152 158.6
[M+H-H2O]+ 193.19562 152.5
[M+HCOO]- 255.19656 174.9
[M+CH3COO]- 269.21221 190.0
[M+Na-2H]- 231.17303 156.1
[M]+ 210.19781 157.9
[M]- 210.19891 157.9
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