CID 209477

19946-20-4

Structural Information

Molecular Formula

C₁₈H₂₁NO

SMILES

C1CC(C(NC1)C(C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C18H21NO/c20-16-12-7-13-19-18(16)17(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16-20H,7,12-13H2

InChIKey

QEQJPYBLAVSEEJ-UHFFFAOYSA-N

Compound name

2-benzhydrylpiperidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 267.16232 Da
Monoisotopic Mass: 3.1
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]+	268.169596	163.8
[M+Na]+	290.151538	166.5
[M-H]-	266.155044	168.0
[M+NH4]+	285.196143	176.3
[M+K]+	306.125478	160.6
[M+H-H2O]+	250.159580	154.6
[M+HCOO]-	312.160521	178.6
[M+CH3COO]-	326.176171	172.5
[M+Na-2H]-	288.136986	166.4
[M]+	267.16177142	155.2
[M]-	267.16286858	155.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe