CID 15100753

1-(1-(4-methoxyphenyl)cyclohexyl)piperidine

Structural Information

Molecular Formula
C18H27NO
SMILES
COC1=CC=C(C=C1)C2(CCCCC2)N3CCCCC3
InChI
InChI=1S/C18H27NO/c1-20-17-10-8-16(9-11-17)18(12-4-2-5-13-18)19-14-6-3-7-15-19/h8-11H,2-7,12-15H2,1H3
InChIKey
MUZGGFNYVLGUFS-UHFFFAOYSA-N
Compound name
1-[1-(4-methoxyphenyl)cyclohexyl]piperidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

33
Patents

273.20926 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.21654 169.0
[M+Na]+ 296.19848 170.8
[M-H]- 272.20198 175.1
[M+NH4]+ 291.24308 184.6
[M+K]+ 312.17242 167.2
[M+H-H2O]+ 256.20652 159.0
[M+HCOO]- 318.20746 183.6
[M+CH3COO]- 332.22311 177.9
[M+Na-2H]- 294.18393 171.2
[M]+ 273.20871 160.6
[M]- 273.20981 160.6
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