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Product Overview

Product Code

TRC-B874740

CAS Number

874748-20-6

Product Format

Neat

Molecular Formula

C30H50BF2N3S4

Molecular Weight

629.81

Product Categories

TRC, Stains & dyes

Product Type

Contaminant

Documentation

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Product Information

Chemical Data

Analyte Name

Coppersensor 1

CAS Number

874748-20-6

Molecular Formula

C30H50BF2N3S4

Molecular Weight

629.81

Accurate Mass

629.2949

SMILES

[F-][B+3]1([F-])N2=C(C)C(=C(C)C2=C(CN(CCSCCSCC)CCSCCSCC)C3=C(C)C(=C(C)[N-]13)CC)CC

InChI

InChI=1S/C30H50BF2N3S4/c1-9-26-22(5)29-28(21-34(13-15-39-19-17-37-11-3)14-16-40-20-18-38-12-4)30-23(6)27(10-2)25(8)36(30)31(32,33)35(29)24(26)7/h9-21H2,1-8H3

IUPAC

N-[(5,11-diethyl-2,2-difluoro-4,6,10,12-tetramethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-8-yl)methyl]-2-(2-ethylsulfanylethylsulfanyl)-N-[2-(2-ethylsulfanylethylsulfanyl)ethyl]ethanamine

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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