CID 206929

28869-92-3

Structural Information

Molecular Formula

C₁₇H₂₇N₂P

SMILES

CC1=CC=C(C=C1)P(N2CCCCC2)N3CCCCC3

InChI

InChI=1S/C17H27N2P/c1-16-8-10-17(11-9-16)20(18-12-4-2-5-13-18)19-14-6-3-7-15-19/h8-11H,2-7,12-15H2,1H3

InChIKey

OVMBYENTCAHZFD-UHFFFAOYSA-N

Compound name

(4-methylphenyl)-di(piperidin-1-yl)phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 290.1912 Da
Monoisotopic Mass: 4.0
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]+	291.19848	173.8
[M+Na]+	313.18042	173.8
[M-H]-	289.18392	176.7
[M+NH4]+	308.22502	185.5
[M+K]+	329.15436	169.9
[M+H-H2O]+	273.18846	160.4
[M+HCOO]-	335.18940	190.9
[M+CH3COO]-	349.20505	203.3
[M+Na-2H]-	311.16587	169.9
[M]+	290.19065	164.1
[M]-	290.19175	164.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe