CID 204989

1-(beta-butoxy-p-chlorophenethyl)piperidine hydrochloride

Structural Information

Molecular Formula
C17H26ClNO
SMILES
CCC(C)OC(CC1=CC=C(C=C1)Cl)N2CCCCC2
InChI
InChI=1S/C17H26ClNO/c1-3-14(2)20-17(19-11-5-4-6-12-19)13-15-7-9-16(18)10-8-15/h7-10,14,17H,3-6,11-13H2,1-2H3
InChIKey
OHXYGBZRKCVLEV-UHFFFAOYSA-N
Compound name
1-[1-butan-2-yloxy-2-(4-chlorophenyl)ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1703 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.17758 171.4
[M+Na]+ 318.15952 183.8
[M+NH4]+ 313.20412 180.0
[M+K]+ 334.13346 175.6
[M-H]- 294.16302 175.2
[M+Na-2H]- 316.14497 177.9
[M]+ 295.16975 174.5
[M]- 295.17085 174.5
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.