Product Code

TRC-E668017

CAS Number

1346598-79-5

Product Format

Neat

Molecular Formula

C15H16D7NO4

Molecular Weight

288.39

Product Categories

TRC, Stable isotopes, API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

81148-15-4

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Esmolol Acid-d7

CAS Number

1346598-79-5

Molecular Formula

C15H16D7NO4

Molecular Weight

288.39

Accurate Mass

288.21

SMILES

OC(CCC1=CC=C(C=C1)OCC(CNC(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H])O)=O

InChI

InChI=1S/C15H23NO4/c1-11(2)16-9-13(17)10-20-14-6-3-12(4-7-14)5-8-15(18)19/h3-4,6-7,11,13,16-17H,5,8-10H2,1-2H3,(H,18,19)/i1D3,2D3,11D

IUPAC

3-(4-(2-hydroxy-3-((propan-2-yl-d7)amino)propoxy)phenyl)propanoic acid

Unlabelled CAS Number

81148-15-4

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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