CID 2915080

1-(cyclohexylcarbonyl)-3-methylpiperidine

Structural Information

Molecular Formula
C13H23NO
SMILES
CC1CCCN(C1)C(=O)C2CCCCC2
InChI
InChI=1S/C13H23NO/c1-11-6-5-9-14(10-11)13(15)12-7-3-2-4-8-12/h11-12H,2-10H2,1H3
InChIKey
NPXDSRAYXKEXAV-UHFFFAOYSA-N
Compound name
cyclohexyl-(3-methylpiperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

209.17796 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.18524 152.3
[M+Na]+ 232.16718 154.0
[M-H]- 208.17068 155.5
[M+NH4]+ 227.21178 169.0
[M+K]+ 248.14112 152.0
[M+H-H2O]+ 192.17522 144.3
[M+HCOO]- 254.17616 166.3
[M+CH3COO]- 268.19181 186.3
[M+Na-2H]- 230.15263 152.7
[M]+ 209.17741 143.2
[M]- 209.17851 143.2
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