CID 56935992

(e,e)-8,10-tetradecadienyl formate

Structural Information

Molecular Formula
C15H26O2
SMILES
CCC/C=C/C=C/CCCCCCCOC=O
InChI
InChI=1S/C15H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-15-16/h4-7,15H,2-3,8-14H2,1H3/b5-4+,7-6+
InChIKey
DQHAHFHJBOKJKJ-YTXTXJHMSA-N
Compound name
[(8E,10E)-tetradeca-8,10-dienyl] formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.19328 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.20056 161.5
[M+Na]+ 261.18250 166.0
[M-H]- 237.18600 160.3
[M+NH4]+ 256.22710 179.4
[M+K]+ 277.15644 162.6
[M+H-H2O]+ 221.19054 155.5
[M+HCOO]- 283.19148 183.5
[M+CH3COO]- 297.20713 194.4
[M+Na-2H]- 259.16795 163.9
[M]+ 238.19273 166.9
[M]- 238.19383 166.9
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.