CID 22559449

1,3-hexadecadien-1-ol

Structural Information

Molecular Formula
C16H30O
SMILES
CCCCCCCCCCCC/C=C/C=C/O
InChI
InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h13-17H,2-12H2,1H3/b14-13+,16-15+
InChIKey
FHOAWAVPBZUXQB-ZBMVRHCNSA-N
Compound name
(1E,3E)-hexadeca-1,3-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

174
Patents

238.22966 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.23694 165.3
[M+Na]+ 261.21888 168.7
[M-H]- 237.22238 162.4
[M+NH4]+ 256.26348 182.6
[M+K]+ 277.19282 164.2
[M+H-H2O]+ 221.22692 159.4
[M+HCOO]- 283.22786 184.9
[M+CH3COO]- 297.24351 193.7
[M+Na-2H]- 259.20433 166.6
[M]+ 238.22911 168.4
[M]- 238.23021 168.4
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