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Product Overview

Product Code

TRC-B690107

CAS Number

1794737-28-2

Product Format

Neat

Molecular Formula

C10H11D5N2O3

Molecular Weight

217.28

Product Type

Stable Isotope Labelled, Impurity

Unlabelled CAS Number

77-28-1

Drug Type

Barbiturates

Documentation

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Product Information

Chemical Data

Analyte Name

Butobarbital-d5

CAS Number

1794737-28-2

Molecular Formula

C10H11D5N2O3

Molecular Weight

217.28

Accurate Mass

217.1475

SMILES

O=C(N1)NC(C(CCCC)(C([2H])([2H])C([2H])([2H])[2H])C1=O)=O

InChI

InChI=1S/C10H16N2O3/c1-3-5-6-10(4-2)7(13)11-9(15)12-8(10)14/h3-6H2,1-2H3,(H2,11,12,13,14,15)/i2D3,4D2

IUPAC

5-butyl-5-(1,1,2,2,2-pentadeuterioethyl)-1,3-diazinane-2,4,6-trione

Unlabelled CAS Number

77-28-1

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

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