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4-tert-Octylphenol-(phenyl-[13C6])

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General Information
Catalog: BLP-005774
Molecular Formula: [13C]6C8H22O
Molecular Weight: 212.28

Chemical Structure

Description	4-tert-Octylphenol-(phenyl-[13C6]) is intended for use as an internal standard for 4-tert-Octylphenol, which is a common environmental pollutant showing weak estrogenic effects. It has been shown to cause harm to the male reproductive system of vertebrates.
Related CAS	140-66-9 (unlabelled)
Canonical SMILES	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O
InChI	InChI=1S/C14H22O/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11/h6-9,15H,10H2,1-5H3/i6+1,7+1,8+1,9+1,11+1,12+1
InChI Key	ISAVYTVYFVQUDY-UJYFPCGESA-N
Purity	97% by CP; 99% atom 13C
Appearance	White Solid