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Product Overview

Product Code

TRC-H950802

CAS Number

1189945-12-7

Product Format

Neat

Molecular Formula

C20H18D6N2O7

Molecular Weight

410.45

Product Categories

TRC, Stable isotopes

Product Type

Bioactive small molecule, Stable Isotope Labelled

Unlabelled CAS Number

106685-70-5

Documentation

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Product Information

Chemical Data

Analyte Name

4-Hydroxy Nisoldipine-d6

CAS Number

1189945-12-7

Molecular Formula

C20H18D6N2O7

Molecular Weight

410.45

Accurate Mass

410.196

SMILES

[2H]C([2H])([2H])C(O)(COC(=O)C1=C(C)NC(=C(C1c2ccccc2[N+](=O)[O-])C(=O)OC)C)C([2H])([2H])[2H]

InChI

InChI=1S/C20H24N2O7/c1-11-15(18(23)28-5)17(13-8-6-7-9-14(13)22(26)27)16(12(2)21-11)19(24)29-10-20(3,4)25/h6-9,17,21,25H,10H2,1-5H3/i3D3,4D3

IUPAC

3-O-methyl 5-O-[3,3,3-trideuterio-2-hydroxy-2-(trideuteriomethyl)propyl] 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Unlabelled CAS Number

106685-70-5

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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4-Hydroxy Nisoldipine-d6

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