CID 15320255

2-cyclopropylcyclopentan-1-one

Structural Information

Molecular Formula
C8H12O
SMILES
C1CC(C(=O)C1)C2CC2
InChI
InChI=1S/C8H12O/c9-8-3-1-2-7(8)6-4-5-6/h6-7H,1-5H2
InChIKey
GEJYWQAQZMUVJL-UHFFFAOYSA-N
Compound name
2-cyclopropylcyclopentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

124.08881 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.09609 124.2
[M+Na]+ 147.07803 133.0
[M-H]- 123.08153 131.6
[M+NH4]+ 142.12263 143.2
[M+K]+ 163.05197 131.0
[M+H-H2O]+ 107.08607 118.7
[M+HCOO]- 169.08701 147.4
[M+CH3COO]- 183.10266 173.8
[M+Na-2H]- 145.06348 128.7
[M]+ 124.08826 123.9
[M]- 124.08936 123.9
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