CID 23383924

1795188-98-5

Structural Information

Molecular Formula

C₁₇H₁₉NO

SMILES

C1CNCCC1(C2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C17H19NO/c19-17(10-12-18-13-11-17)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-9,18-19H,10-13H2

InChIKey

REUFEAYWUYVNKD-UHFFFAOYSA-N

Compound name

4-(4-phenylphenyl)piperidin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 253.14667 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]+	254.153946	160.8
[M+Na]+	276.135888	165.5
[M-H]-	252.139394	165.7
[M+NH4]+	271.180493	176.2
[M+K]+	292.109828	159.6
[M+H-H2O]+	236.143930	152.0
[M+HCOO]-	298.144871	177.2
[M+CH3COO]-	312.160521	170.6
[M+Na-2H]-	274.121336	166.0
[M]+	253.14612142	152.9
[M]-	253.14721858	152.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe