CID 89673

2-cyclopentylcyclopent-2-en-1-one

Structural Information

Molecular Formula
C10H14O
SMILES
C1CCC(C1)C2=CCCC2=O
InChI
InChI=1S/C10H14O/c11-10-7-3-6-9(10)8-4-1-2-5-8/h6,8H,1-5,7H2
InChIKey
IAHUXRDIKWJXQM-UHFFFAOYSA-N
Compound name
2-cyclopentylcyclopent-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

150.10446 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.11174 134.8
[M+Na]+ 173.09368 144.6
[M+NH4]+ 168.13828 144.4
[M+K]+ 189.06762 141.6
[M-H]- 149.09718 137.9
[M+Na-2H]- 171.07913 140.1
[M]+ 150.10391 136.8
[M]- 150.10501 136.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe