Vitas-M small molecule compound
5,5,6-trimethyl-2-{3-methyl-3-[(2-methylbutan-2-yl)peroxy]but-1-yn-1-yl}bicyclo[2.2.1]heptan-2-ol
Catalog ID
STL570390
SMILES CCC(OOC(C#CC1(O)CC2CC1C(C2(C)C)C)(C)C)(C)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 C20H34O3 MW 322.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H34O3/c1-9-17(3,4)22-23-18(5,6)10-11-20(21)13-15-12-16(20)14(2)19(15,7)8/h14-16,21H,9,12-13H2,1-8H3InChIKey
QSEHPXZLHGUBIT-UHFFFAOYSA-NSynonyms
(1R2R4R6S)556trimethyl2(3methyl3(tertpentylperoxy)but1yn1yl)bicyclo(221)heptan2ol
3312085
556trimethyl2(3methyl3((2methylbutan2yl)peroxy)but1yn1yl)bicyclo(221)heptan2ol
556trimethyl2(3methyl3(2methylbutan2ylperoxy)but1ynyl)bicyclo(221)heptan2ol
InChI=1SC20H34O3c1917(34)222318(56)101120(21)13151216(20)14(2)19(157)8h141621H91213H218H3
MFCD01545589
ZINC000100755846
ZINC000252694841
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