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
2
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]+ 153.127396 131.1
[M+Na]+ 175.109338 135.6
[M-H]- 151.112844 131.2
[M+NH4]+ 170.153943 149.3
[M+K]+ 191.083278 135.2
[M+H-H2O]+ 135.117380 128.6
[M+HCOO]- 197.118321 151.1
[M+CH3COO]- 211.133971 170.6
[M+Na-2H]- 173.094786 135.7
[M]+ 152.11957142 123.3
[M]- 152.12066858 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.