CID 96390

83833-31-2

Structural Information

Molecular Formula

C₁₃H₁₈N₂O

SMILES

C1CNCCC1(CNC=O)C2=CC=CC=C2

InChI

InChI=1S/C13H18N2O/c16-11-15-10-13(6-8-14-9-7-13)12-4-2-1-3-5-12/h1-5,11,14H,6-10H2,(H,15,16)

InChIKey

SRILTGVFXCDKLM-UHFFFAOYSA-N

Compound name

N-[(4-phenylpiperidin-4-yl)methyl]formamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 218.1419 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]+	219.149176	150.5
[M+Na]+	241.131118	154.4
[M-H]-	217.134624	153.3
[M+NH4]+	236.175723	167.8
[M+K]+	257.105058	150.4
[M+H-H2O]+	201.139160	142.7
[M+HCOO]-	263.140101	169.6
[M+CH3COO]-	277.155751	185.7
[M+Na-2H]-	239.116566	157.1
[M]+	218.14135142	143.9
[M]-	218.14244858	143.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe