CID 56935897

(z,z)-6,9-eicosadien-11-ol

Structural Information

Molecular Formula
C20H38O
SMILES
CCCCCCCCCC(/C=C\C/C=C\CCCCC)O
InChI
InChI=1S/C20H38O/c1-3-5-7-9-11-13-15-17-19-20(21)18-16-14-12-10-8-6-4-2/h11,13,17,19-21H,3-10,12,14-16,18H2,1-2H3/b13-11-,19-17-
InChIKey
HLRILOHBDLRFQX-OHNCOSGTSA-N
Compound name
(11Z,14Z)-icosa-11,14-dien-10-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

294.29227 Da
Monoisotopic Mass

7.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.29955 184.0
[M+Na]+ 317.28149 185.5
[M-H]- 293.28499 180.4
[M+NH4]+ 312.32609 199.0
[M+K]+ 333.25543 180.4
[M+H-H2O]+ 277.28953 177.5
[M+HCOO]- 339.29047 201.3
[M+CH3COO]- 353.30612 206.4
[M+Na-2H]- 315.26694 181.8
[M]+ 294.29172 187.9
[M]- 294.29282 187.9
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