Rotundone-d5

Catalog Number	ACMA00026218
IUPAC Name	(5R,8S)-2,2,3,4,4-pentadeuterio-3,8-dimethyl-5-prop-1-en-2-yl-5,6,7,8-tetrahydroazulen-1-one
Molecular Weight	223.36
Molecular Formula	C15H17D5O
InChI	InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)15-13(8-12)11(4)7-14(15)16/h10-12H,1,5-8H2,2-4H3/t10-,11?,12+/m0/s1/i7D2,8D2,11D
InChI Key	NUWMTBMCSQWPDG-GZOABBLZSA-N
Purity	90% min
Isomeric SMILES	[2H]C1([C@@H](CC[C@@H](C2=C1C(C(C2=O)([2H])[2H])([2H])C)C)C(=C)C)[2H]
Unlabeled CAS	18374-76-0

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Rotundone-d5 (ACMA00026218)

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