CID 3047538

Pyridine, 1,2,3,6-tetrahydro-1-(cyclohexylcarbonyl)-

Structural Information

Molecular Formula
C12H19NO
SMILES
C1CCC(CC1)C(=O)N2CCC=CC2
InChI
InChI=1S/C12H19NO/c14-12(11-7-3-1-4-8-11)13-9-5-2-6-10-13/h2,5,11H,1,3-4,6-10H2
InChIKey
WLAJTKMPLRCMSD-UHFFFAOYSA-N
Compound name
cyclohexyl(3,6-dihydro-2H-pyridin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.14667 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.153946 146.1
[M+Na]+ 216.135888 148.3
[M-H]- 192.139394 149.5
[M+NH4]+ 211.180493 163.2
[M+K]+ 232.109828 146.3
[M+H-H2O]+ 176.143930 138.1
[M+HCOO]- 238.144871 162.0
[M+CH3COO]- 252.160521 181.8
[M+Na-2H]- 214.121336 148.9
[M]+ 193.14612142 137.7
[M]- 193.14721858 137.7
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

No patent data available for this compound.