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
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 133.9
[M+Na]+ 173.09368 140.2
[M-H]- 149.09718 140.3
[M+NH4]+ 168.13828 158.3
[M+K]+ 189.06762 138.4
[M+H-H2O]+ 133.10172 128.6
[M+HCOO]- 195.10266 157.2
[M+CH3COO]- 209.11831 173.8
[M+Na-2H]- 171.07913 135.5
[M]+ 150.10391 129.9
[M]- 150.10501 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