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Product Overview

Product Code

TRC-B233025

CAS Number

76335-62-1

Product Format

Neat

Molecular Formula

C17H22N2O3S

Molecular Weight

334.43

API Family

Biotin

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity

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Product Information

Chemical Data

Analyte Name

1'N-Benzyl Biotin

CAS Number

76335-62-1

Molecular Formula

C17H22N2O3S

Molecular Weight

334.43

Accurate Mass

334.1351

SMILES

OC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2Cc3ccccc3

InChI

InChI=1S/C17H22N2O3S/c20-15(21)9-5-4-8-14-16-13(11-23-14)19(17(22)18-16)10-12-6-2-1-3-7-12/h1-3,6-7,13-14,16H,4-5,8-11H2,(H,18,22)(H,20,21)/t13-,14-,16-/m0/s1

IUPAC

5-[(3aR,6S,6aS)-3-benzyl-2-oxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-6-yl]pentanoic acid

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Biotin

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