PubChemLite - 74974-14-4 (C44H34N2P2)

Structural Information

Molecular Formula

SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)NC3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)NP(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C44H34N2P2/c1-5-19-35(20-6-1)47(36-21-7-2-8-22-36)45-41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)46-48(37-23-9-3-10-24-37)38-25-11-4-12-26-38/h1-32,45-46H

InChIKey

NRWZSRQDRSYPNW-UHFFFAOYSA-N

Compound name

N-diphenylphosphanyl-1-[2-(diphenylphosphanylamino)naphthalen-1-yl]naphthalen-2-amine

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]+	653.22698	268.9
[M+Na]+	675.20892	289.3
[M+NH4]+	670.25352	277.9
[M+K]+	691.18286	273.3
[M-H]-	651.21242	285.4
[M+Na-2H]-	673.19437	284.3
[M]+	652.21915	277.1
[M]-	652.22025	277.1

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

653.22698

268.9

[M+Na]+

675.20892

289.3

[M+NH4]+

670.25352

277.9

[M+K]+

691.18286

273.3

[M-H]-

651.21242

285.4

[M+Na-2H]-

673.19437

284.3

[M]+

652.21915

277.1

[M]-

652.22025

277.1

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

74974-14-4

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

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