CID 3064330

4-piperidinol, 4-(p-chlorophenyl)-1-cyclopropyl-, hydrochloride

Structural Information

Molecular Formula

C₁₄H₁₈ClNO

SMILES

C1CC1N2CCC(CC2)(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C14H18ClNO/c15-12-3-1-11(2-4-12)14(17)7-9-16(10-8-14)13-5-6-13/h1-4,13,17H,5-10H2

InChIKey

OLKDQUKVLXCZNK-UHFFFAOYSA-N

Compound name

4-(4-chlorophenyl)-1-cyclopropylpiperidin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 251.1077 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	252.114976	155.3
[M+Na]+	274.096918	163.4
[M-H]-	250.100424	162.2
[M+NH4]+	269.141523	168.2
[M+K]+	290.070858	158.7
[M+H-H2O]+	234.104960	148.3
[M+HCOO]-	296.105901	168.8
[M+CH3COO]-	310.121551	166.1
[M+Na-2H]-	272.082366	159.4
[M]+	251.10715142	154.4
[M]-	251.10824858	154.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.