CID 131749437

(e)-(6,10-dimethylundeca-1,5,9-trien-2-yl)cyclopropane

Structural Information

Molecular Formula
C16H26
SMILES
CC(=CCC/C(=C/CCC(=C)C1CC1)/C)C
InChI
InChI=1S/C16H26/c1-13(2)7-5-8-14(3)9-6-10-15(4)16-11-12-16/h7,9,16H,4-6,8,10-12H2,1-3H3/b14-9+
InChIKey
KWJSWFXHRJLFSX-NTEUORMPSA-N
Compound name
[(5E)-6,10-dimethylundeca-1,5,9-trien-2-yl]cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

218.20345 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.21073 154.7
[M+Na]+ 241.19267 160.2
[M-H]- 217.19617 158.2
[M+NH4]+ 236.23727 168.6
[M+K]+ 257.16661 155.9
[M+H-H2O]+ 201.20071 148.2
[M+HCOO]- 263.20165 173.6
[M+CH3COO]- 277.21730 197.0
[M+Na-2H]- 239.17812 154.0
[M]+ 218.20290 156.8
[M]- 218.20400 156.8
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