CID 339086

Phenyl-piperidin-4-yl-methanol

Structural Information

Molecular Formula

C₁₂H₁₇NO

SMILES

C1CNCCC1C(C2=CC=CC=C2)O

InChI

InChI=1S/C12H17NO/c14-12(10-4-2-1-3-5-10)11-6-8-13-9-7-11/h1-5,11-14H,6-9H2

InChIKey

DUZLYYVHAOTWSF-UHFFFAOYSA-N

Compound name

phenyl(piperidin-4-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 114
Patents: 191.13101 Da
Monoisotopic Mass: 1.4
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]+	192.138286	144.2
[M+Na]+	214.120228	147.4
[M-H]-	190.123734	145.5
[M+NH4]+	209.164833	160.2
[M+K]+	230.094168	143.6
[M+H-H2O]+	174.128270	136.8
[M+HCOO]-	236.129211	159.8
[M+CH3COO]-	250.144861	177.4
[M+Na-2H]-	212.105676	148.2
[M]+	191.13046142	135.8
[M]-	191.13155858	135.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe