CID 56936113

6z,9z-docosadiene

Structural Information

Molecular Formula
C22H42
SMILES
CCCCCCCCCCCC/C=C\C/C=C\CCCCC
InChI
InChI=1S/C22H42/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-22H2,1-2H3/b13-11-,19-17-
InChIKey
FERBAYKGLZCVJS-OHNCOSGTSA-N
Compound name
(6Z,9Z)-docosa-6,9-diene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

306.32864 Da
Monoisotopic Mass

10.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.33592 188.1
[M+Na]+ 329.31786 189.5
[M-H]- 305.32136 185.6
[M+NH4]+ 324.36246 203.5
[M+K]+ 345.29180 183.9
[M+H-H2O]+ 289.32590 181.1
[M+HCOO]- 351.32684 207.1
[M+CH3COO]- 365.34249 212.6
[M+Na-2H]- 327.30331 186.8
[M]+ 306.32809 194.0
[M]- 306.32919 194.0
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