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Product Overview

Product Code

TRC-R144562

CAS Number

1329836-95-4

Product Format

Neat

Molecular Formula

C20H17D4NO5

Molecular Weight

359.41

API Family

Repirinast

Product Categories

Additional Toxicology Reference Materials , API Reference Standards & Research Materials, Additional pharmaceutical toxicology reference materials, Additional pharmaceutical toxicology research materials, Stable isotopes, TRC

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

73080-51-0

Documentation

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Product Information

Chemical Data

Analyte Name

Repirinast-d4

CAS Number

1329836-95-4

Molecular Formula

C20H17D4NO5

Molecular Weight

359.41

Accurate Mass

359.17

SMILES

O=C1NC2=C(C)C(C)=CC=C2C3=C1C(C=C(C(OC([2H])([2H])C([2H])([2H])C(C)C)=O)O3)=O

InChI

InChI=1S/C20H21NO5/c1-10(2)7-8-25-20(24)15-9-14(22)16-18(26-15)13-6-5-11(3)12(4)17(13)21-19(16)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,23)/i7D2,8D2

IUPAC

3-methylbutyl-1,1,2,2-d4 7,8-dimethyl-4,5-dioxo-5,6-dihydro-4H-pyrano[3,2-c]quinoline-2-carboxylate

Unlabelled CAS Number

73080-51-0

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Repirinast

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Chemical Data

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Repirinast-d4

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