CID 56936063

4,6-dimethyl-2e,4e,6e-nonatriene

Structural Information

Molecular Formula
C11H18
SMILES
CC/C=C(\C)/C=C(\C)/C=C/C
InChI
InChI=1S/C11H18/c1-5-7-10(3)9-11(4)8-6-2/h5,7-9H,6H2,1-4H3/b7-5+,10-9+,11-8+
InChIKey
TZSBLOZYIXZKCN-MROCENOWSA-N
Compound name
(2E,4E,6E)-4,6-dimethylnona-2,4,6-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.14085 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.14813 137.5
[M+Na]+ 173.13007 143.4
[M-H]- 149.13357 137.4
[M+NH4]+ 168.17467 159.1
[M+K]+ 189.10401 141.1
[M+H-H2O]+ 133.13811 133.1
[M+HCOO]- 195.13905 158.4
[M+CH3COO]- 209.15470 179.4
[M+Na-2H]- 171.11552 139.7
[M]+ 150.14030 137.1
[M]- 150.14140 137.1
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

No patent data available for this compound.