Vitas-M small molecule compound

5,8,8-trimethyl-2,4-dioxo-3-oxabicyclo[3.2.1]octane-1-carboxylic acid

Catalog ID
STL553073
SMILES OC(=O)C12CCC(C2(C)C)(C(=O)OC1=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C11H14O5 MW 226.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14O5/c1-9(2)10(3)4-5-11(9,6(12)13)8(15)16-7(10)14/h4-5H2,1-3H3,(H,12,13)
InChIKey
NTHKEGKZDDYTEV-UHFFFAOYSA-N
Synonyms
1212445-41-4
(1R5S)588trimethyl24dioxo3oxabicyclo(321)octane1carboxylicacid
1212445414
188TRIMETHYL24DIOXO3OXABICYCLO(321)OCTANE5CARBOXYLICACID
2770821
588trimethyl24dioxo3oxabicyclo(321)octane1carboxylicacid
InChI=1SC11H14O5c19(2)10(3)4511(96(12)13)8(15)167(10)14h45H213H3(H1213)
ZINC000070673111

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.