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Product Overview

Product Code

TRC-V676080

CAS Number

84-80-0

Product Format

Neat

Molecular Formula

C31 H46 O2

Molecular Weight

450.70

API Family

Phytomenadione, Vitamin K1

Product Categories

API Reference Standards & Research Materials, Vitamins and derivatives, Vitamins, Vitamins and derivatives, Pharmaceutical and Veterinary Residue Reference Materials , Pharmaceutical, Veterinary Compound & Metabolite Reference Materials , TRC, Pharmaceutical and veterinary compounds and metabolites Reference Materials , Vitamins

Product Type

Bioactive Small Molecule, API

Drug Type

Vitamins & Derivatives

Documentation

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Product Information

Chemical Data

Analyte Name

Vitamin K1 (Phytonadione)

CAS Number

84-80-0

Molecular Formula

C31 H46 O2

Molecular Weight

450.70

Accurate Mass

450.3498

SMILES

CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC\C(=C\CC1=C(C)C(=O)c2ccccc2C1=O)\C

InChI

InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1

IUPAC

2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione

Product Data

Storage Temperature

+4°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Type

API

Product Format

Neat

API Family

Phytomenadione; Vitamin K1

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Vitamin K1

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