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Bisphenol B-[13C12]

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General Information
Catalog: BLP-003479
Molecular Formula: C4[13C]12H18O2
Molecular Weight: 254.22

Chemical Structure

Description	Bisphenol B-[13C12] is the labelled form of Bisphenol B, an analogue of Bisphenol A.
Synonyms	4-{2-[4-hydroxy(1,2,3,4,5,6-13C6)phenyl]butan-2-yl}(1,2,3,4,5,6-13C6)phenol
IUPAC Name	4-[2-(4-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)butan-2-yl](1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-ol
Related CAS	77-40-7 (unlabelled)
Canonical SMILES	CCC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
InChI	InChI=1S/C16H18O2/c1-3-16(2,12-4-8-14(17)9-5-12)13-6-10-15(18)11-7-13/h4-11,17-18H,3H2,1-2H3/i4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1
InChI Key	HTVITOHKHWFJKO-MWDCNEGOSA-N
Purity	> 98%