CID 24974300

3-cyclopropylcyclopentan-1-one

Structural Information

Molecular Formula
C8H12O
SMILES
C1CC1C2CCC(=O)C2
InChI
InChI=1S/C8H12O/c9-8-4-3-7(5-8)6-1-2-6/h6-7H,1-5H2
InChIKey
AJEBGULHJHRRGC-UHFFFAOYSA-N
Compound name
3-cyclopropylcyclopentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

124.08881 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.09609 127.7
[M+Na]+ 147.07803 139.6
[M+NH4]+ 142.12263 137.7
[M+K]+ 163.05197 136.5
[M-H]- 123.08153 137.3
[M+Na-2H]- 145.06348 135.8
[M]+ 124.08826 133.0
[M]- 124.08936 133.0
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