CID 56936059

7,11,15-trimethyl-3-methylenehexadeca-1,6e,10e,14-tetraene

Structural Information

Molecular Formula
C20H34
SMILES
CCC(=C)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C
InChI
InChI=1S/C20H34/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h11,14-15H,4,7-10,12-13,16H2,1-3,5-6H3/b19-15+,20-14+
InChIKey
CLVVJUWXXRJNRE-YTOAGJIJSA-N
Compound name
(6E,10E)-2,6,10-trimethyl-14-methylidenehexadeca-2,6,10-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.26605 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.27333 177.1
[M+Na]+ 297.25527 179.2
[M-H]- 273.25877 175.5
[M+NH4]+ 292.29987 193.5
[M+K]+ 313.22921 174.7
[M+H-H2O]+ 257.26331 171.2
[M+HCOO]- 319.26425 193.2
[M+CH3COO]- 333.27990 207.2
[M+Na-2H]- 295.24072 172.0
[M]+ 274.26550 178.1
[M]- 274.26660 178.1
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

No patent data available for this compound.