CID 162129

52736-58-0

Structural Information

Molecular Formula
C12H19NO
SMILES
C1CCN(CC1)C(=O)C2CCC=CC2
InChI
InChI=1S/C12H19NO/c14-12(11-7-3-1-4-8-11)13-9-5-2-6-10-13/h1,3,11H,2,4-10H2
InChIKey
FFHOWNJPAGBREV-UHFFFAOYSA-N
Compound name
cyclohex-3-en-1-yl(piperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

56
Patents

193.14667 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.15395 147.2
[M+Na]+ 216.13589 158.0
[M+NH4]+ 211.18049 156.2
[M+K]+ 232.10983 151.1
[M-H]- 192.13939 150.7
[M+Na-2H]- 214.12134 153.5
[M]+ 193.14612 149.5
[M]- 193.14722 149.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe