Vitas-M small molecule compound
3-methyl-3-phenyl-3a,4,7,7a-tetrahydro-2-benzofuran-1(3H)-one
Catalog ID
STL328679
SMILES O=C1OC(C2C1CC=CC2)(C)c1ccccc1
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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 C15H16O2 MW 228.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16O2/c1-15(11-7-3-2-4-8-11)13-10-6-5-9-12(13)14(16)17-15/h2-8,12-13H,9-10H2,1H3InChIKey
TYWXTPZJOBOWNJ-UHFFFAOYSA-NSynonyms
95126-94-6(3aR7aR)3methyl3phenyl3a477atetrahydroisobenzofuran1(3H)one
3methyl3phenyl3a477atetrahydro2benzofuran1(3H)one
3methyl3phenyl3a477atetrahydro2benzofuran1one
3METHYL3PHENYL3A477ATETRAHYDROISOBENZOFURAN1(3H)ONE
95126946
CC1(C2CC=CCC2C(=O)O1)C3=CC=CC=C3
InChI=1SC15H16O2c115(117324811)131065912(13)14(16)1715h281213H910H21H3
MFCD01002971
O=C1OC((C@H)2(C@H)1CC=CC2)(C)c1ccccc1
ZINC000000491230
ZINC000012384163
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