CID 91150

24238-82-2

Structural Information

Molecular Formula
C13H22
SMILES
CC(=CCCC(=CCCC=C)C)C
InChI
InChI=1S/C13H22/c1-5-6-7-10-13(4)11-8-9-12(2)3/h5,9-10H,1,6-8,11H2,2-4H3
InChIKey
VHIVJUNIYOCPSI-UHFFFAOYSA-N
Compound name
6,10-dimethylundeca-1,5,9-triene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

357
Patents

178.17215 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.179426 146.7
[M+Na]+ 201.161368 151.7
[M-H]- 177.164874 146.2
[M+NH4]+ 196.205973 167.0
[M+K]+ 217.135308 148.8
[M+H-H2O]+ 161.169410 141.8
[M+HCOO]- 223.170351 166.9
[M+CH3COO]- 237.186001 186.1
[M+Na-2H]- 199.146816 147.8
[M]+ 178.17160142 147.1
[M]- 178.17269858 147.1
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

patents stripe