CID 6436736

9,12-tetradecadien-1-ol, (z,e)-

Structural Information

Molecular Formula
C14H26O
SMILES
C/C=C\C/C=C/CCCCCCCCO
InChI
InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-3,5-6,15H,4,7-14H2,1H3/b3-2-,6-5+
InChIKey
IHRPKOQVBCPMQH-NDEAWQBTSA-N
Compound name
(9E,12Z)-tetradeca-9,12-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

222
Patents

210.19836 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.205636 156.3
[M+Na]+ 233.187578 160.6
[M-H]- 209.191084 153.8
[M+NH4]+ 228.232183 174.8
[M+K]+ 249.161518 156.6
[M+H-H2O]+ 193.195620 150.9
[M+HCOO]- 255.196561 176.6
[M+CH3COO]- 269.212211 187.6
[M+Na-2H]- 231.173026 158.7
[M]+ 210.19781142 158.6
[M]- 210.19890858 158.6
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.