CID 87490883

Schembl3188597

Structural Information

Molecular Formula
C15H28O
SMILES
CC/C=C\C=C/CCCCCCCCCO
InChI
InChI=1S/C15H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h3-6,16H,2,7-15H2,1H3/b4-3-,6-5-
InChIKey
DLKZADOXJGINMI-OUPQRBNQSA-N
Compound name
(10Z,12Z)-pentadeca-10,12-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

224.21402 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.22130 160.8
[M+Na]+ 247.20324 164.6
[M-H]- 223.20674 158.1
[M+NH4]+ 242.24784 178.7
[M+K]+ 263.17718 160.4
[M+H-H2O]+ 207.21128 155.2
[M+HCOO]- 269.21222 180.8
[M+CH3COO]- 283.22787 190.7
[M+Na-2H]- 245.18869 162.6
[M]+ 224.21347 163.5
[M]- 224.21457 163.5
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.