CID 12653611

1-cyclopentylpiperidin-4-one

Structural Information

Molecular Formula
C10H17NO
SMILES
C1CCC(C1)N2CCC(=O)CC2
InChI
InChI=1S/C10H17NO/c12-10-5-7-11(8-6-10)9-3-1-2-4-9/h9H,1-8H2
InChIKey
OJEDWBCGPOCKJW-UHFFFAOYSA-N
Compound name
1-cyclopentylpiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

167.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 139.0
[M+Na]+ 190.12023 143.2
[M-H]- 166.12373 143.0
[M+NH4]+ 185.16483 159.3
[M+K]+ 206.09417 141.4
[M+H-H2O]+ 150.12827 131.8
[M+HCOO]- 212.12921 157.2
[M+CH3COO]- 226.14486 176.7
[M+Na-2H]- 188.10568 140.7
[M]+ 167.13046 131.7
[M]- 167.13156 131.7
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