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Product Overview

Product Code

TRC-D473137

CAS Number

1173019-36-7

Product Format

Neat

Molecular Formula

13C6 C13 H32 O3

Molecular Weight

314.411

Product Categories

TRC, Stable isotopes, Impurity Reference Materials , Phenol and Aromatic Compound Reference Materials

Product Type

Impurity, Stable Isotope Labelled

Unlabelled CAS Number

1119449-38-5

Documentation

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Product Information

Chemical Data

Analyte Name

4-(1-Ethyl-1,4-dimethylpentyl)-phenol-di-ethoxylate 13C6

CAS Number

1173019-36-7

Molecular Formula

13C6 C13 H32 O3

Molecular Weight

314.411

Accurate Mass

314.255

SMILES

CCC(C)(CCC(C)C)[13c]1[13cH][13cH][13c](OCCOCCO)[13cH][13cH]1

InChI

InChI=1S/C19H32O3/c1-5-19(4,11-10-16(2)3)17-6-8-18(9-7-17)22-15-14-21-13-12-20/h6-9,16,20H,5,10-15H2,1-4H3/i6+1,7+1,8+1,9+1,17+1,18+1

IUPAC

2-[2-[4-(3,6-dimethylheptan-3-yl)(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-trien-1-yl]oxyethoxy]ethanol

Unlabelled CAS Number

1119449-38-5

SIL Type

Carbon

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Chemical Data

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4-(3’,6’-Dimethyl-3’-heptyl)phenol diethoxylate-13C6

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