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Fumaric acid-[1-13C,2,3-d2]

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General Information
Catalog: BLP-000617
CAS: 1018681-16-7
Molecular Formula: C3[13C]H2D2O4
Molecular Weight: 119.08

Chemical Structure

Description	Fumaric acid-[1-13C,2,3-d2] is the labelled analogue of Fumaric acid. Fumaric acid is isolated from the herbs of Fumaria officinalis. It is an antioxidant and a potentially toxic compound used mainly in paints and plastics.
Synonyms	Fumaric acid-1-13C,2,3-d2; 13C1-fumaric acid-d2; [1-(13)C-2,3-d2]fumaric acid; 1-(13)C-2,3-dideutriofumaric acid; 1-13C-fumaric acid-d2
IUPAC Name	(E)-2,3-dideuterio(2-13C)but-2-enedioic acid
Related CAS	110-17-8 (unlabelled)
Canonical SMILES	C(=CC(=O)O)C(=O)O
InChI	InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+/i1D,2D,3+1
InChI Key	VZCYOOQTPOCHFL-KGGDLBJGSA-N
Purity	99% (CP); 97% atom D; 99% atom 13C