CID 5318635

(e)-6,10-dimethyl-9-methylene-5-undecen-2-one

Structural Information

Molecular Formula
C14H24O
SMILES
CC(C)C(=C)CC/C(=C/CCC(=O)C)/C
InChI
InChI=1S/C14H24O/c1-11(2)13(4)10-9-12(3)7-6-8-14(5)15/h7,11H,4,6,8-10H2,1-3,5H3/b12-7+
InChIKey
GVHYGHSXSIDTDI-KPKJPENVSA-N
Compound name
(E)-6,10-dimethyl-9-methylideneundec-5-en-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

208.18271 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.18999 155.1
[M+Na]+ 231.17193 163.4
[M+NH4]+ 226.21653 161.4
[M+K]+ 247.14587 158.1
[M-H]- 207.17543 153.4
[M+Na-2H]- 229.15738 155.9
[M]+ 208.18216 155.5
[M]- 208.18326 155.5
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

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