CID 5875489

4-cyclodecen-1-one

Structural Information

Molecular Formula
C10H16O
SMILES
C1CC/C=C\CCC(=O)CC1
InChI
InChI=1S/C10H16O/c11-10-8-6-4-2-1-3-5-7-9-10/h2,4H,1,3,5-9H2/b4-2-
InChIKey
CTKZAJHVNKRDOI-RQOWECAXSA-N
Compound name
(4Z)-cyclodec-4-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.12012 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.12740 131.1
[M+Na]+ 175.10934 135.6
[M-H]- 151.11284 131.2
[M+NH4]+ 170.15394 149.3
[M+K]+ 191.08328 135.2
[M+H-H2O]+ 135.11738 128.6
[M+HCOO]- 197.11832 151.1
[M+CH3COO]- 211.13397 170.6
[M+Na-2H]- 173.09479 135.7
[M]+ 152.11957 123.3
[M]- 152.12067 123.3
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.