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Merck
CN

PHL89279

Sinigrin potassium salt

phyproof® Reference Substance

Synonym(s):

2-Propenyl glucosinolate potassium salt, Allylglucosinolate potassium salt

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About This Item

Empirical Formula (Hill Notation):
C10H16KNO9S2
CAS Number:
Molecular Weight:
397.46
NACRES:
NA.24
UNSPSC Code:
41116107
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grade

primary reference standard

product line

phyproof® Reference Substance

assay

≥95.0% (HPLC)

manufacturer/tradename

PhytoLab

application(s)

food and beverages

format

neat

storage temp.

2-8°C

SMILES string

O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1S/C(CC=C)=N/OS(=O)(O[K])=O

InChI

1S/C10H17NO9S2.K/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);/q;+1/p-1/b11-6+;/t5-,7-,8+,9-,10+;/m1./s1

InChI key

QKFAFSGJTMHRRY-OCFLFPRFSA-M

General description

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG

Legal Information

phyproof is a registered trademark of PhytoLab GmbH & Co. KG


pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Skin Sens. 1

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable



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