PubChemLite - Tri-o-tolylphosphine (C21H21P)

Structural Information

Molecular Formula

C₂₁H₂₁P

SMILES

CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C

InChI

InChI=1S/C21H21P/c1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3/h4-15H,1-3H3

InChIKey

COIOYMYWGDAQPM-UHFFFAOYSA-N

Compound name

tris(2-methylphenyl)phosphane

Related CIDs

2D Structure

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]+	305.14538	175.1
[M+Na]+	327.12732	192.6
[M+NH4]+	322.17192	185.2
[M+K]+	343.10126	182.1
[M-H]-	303.13082	183.5
[M+Na-2H]-	325.11277	187.2
[M]+	304.13755	180.4
[M]-	304.13865	180.4

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

305.14538

175.1

[M+Na]+

327.12732

192.6

[M+NH4]+

322.17192

185.2

[M+K]+

343.10126

182.1

[M-H]-

303.13082

183.5

[M+Na-2H]-

325.11277

187.2

[M]+

304.13755

180.4

[M]-

304.13865

180.4

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Tri-o-tolylphosphine

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe