Vitas-M small molecule compound
4-({2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl}methyl)-4-methylmorpholin-4-ium
Catalog ID
STK088908
SMILES C[N+]1(CCOCC1)CC1COC(O1)CCc1ccc(cc1)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 C21H34NO3 MW 348.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H34NO3/c1-21(2,3)18-8-5-17(6-9-18)7-10-20-24-16-19(25-20)15-22(4)11-13-23-14-12-22/h5-6,8-9,19-20H,7,10-16H2,1-4H3/q+1InChIKey
XGSOAQKWLVYPTJ-UHFFFAOYSA-NSynonyms
4((2(2(4TERTBUTYLPHENYL)ETHYL)13DIOXOLAN4YL)METHYL)4METHYLMORPHOLIN4IUM
4((2(4(tertbutyl)phenethyl)13dioxolan4yl)methyl)4methylmorpholin4iumiodide
C(N+)1(CCOCC1)CC1COC(O1)CCc1ccc(cc1)C(C)(C)C
C(N+)1(CCOCC1)CC1COC(O1)CCc1ccc(cc1)C(C)(C)C(I)
CC(C)(C)C1=CC=C(C=C1)CCC2OCC(O2)C(N+)3(CCOCC3)C
InChI=1SC21H34NO3c121(23)188517(6918)71020241619(2520)1522(4)111323141222h56891920H71016H214H3q+1
MFCD03304579
STK088908
ZINC000000202490
ZINC000000202500
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