Vitas-M small molecule compound

2-(1,3-benzodioxol-5-yl)-N,N,N-trimethyl-2-oxoethanaminium

Catalog ID
STL343913
SMILES O=C(c1ccc2c(c1)OCO2)C[N+](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 C12H16NO3 MW 222.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16NO3/c1-13(2,3)7-10(14)9-4-5-11-12(6-9)16-8-15-11/h4-6H,7-8H2,1-3H3/q+1
InChIKey
FOFQQFZPLBQJPA-UHFFFAOYSA-N
Synonyms

(2(13BENZODIOXOL5YL)2OXOETHYL)TRIMETHYLAZANIUM
2(13benzodioxol5yl)NNNtrimethyl2oxoethanaminium
C(N+)(C)(C)CC(=O)C1=CC2=C(C=C1)OCO2
InChI=1SC12H16NO3c113(23)710(14)9451112(69)1681511h46H78H213H3q+1
MFCD01116975
O=C(c1ccc2c(c1)OCO2)C(N+)(C)(C)C
ZINC000002418752
ZINC02418752
ZINC2418752

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Available files

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