CID 12305704

(5z)-5-methyl-9-methylidene-2-propan-2-ylcyclodec-5-en-1-one

Structural Information

Molecular Formula
C15H24O
SMILES
C/C/1=C/CCC(=C)CC(=O)C(CC1)C(C)C
InChI
InChI=1S/C15H24O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h6,11,14H,4-5,7-10H2,1-3H3/b12-6-
InChIKey
QTFJNWQFKJITEE-SDQBBNPISA-N
Compound name
(5Z)-5-methyl-9-methylidene-2-propan-2-ylcyclodec-5-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.18271 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.18999 149.7
[M+Na]+ 243.17193 155.2
[M-H]- 219.17543 150.4
[M+NH4]+ 238.21653 166.2
[M+K]+ 259.14587 153.4
[M+H-H2O]+ 203.17997 147.5
[M+HCOO]- 265.18091 167.4
[M+CH3COO]- 279.19656 189.0
[M+Na-2H]- 241.15738 148.7
[M]+ 220.18216 143.8
[M]- 220.18326 143.8
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.