CID 89673

2-cyclopenten-1-one, 2-cyclopentyl-

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
2
Annotation Hits

0
References

12
Patents

150.10446 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.111736 133.9
[M+Na]+ 173.093678 140.2
[M-H]- 149.097184 140.3
[M+NH4]+ 168.138283 158.3
[M+K]+ 189.067618 138.4
[M+H-H2O]+ 133.101720 128.6
[M+HCOO]- 195.102661 157.2
[M+CH3COO]- 209.118311 173.8
[M+Na-2H]- 171.079126 135.5
[M]+ 150.10391142 129.9
[M]- 150.10500858 129.9
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