Vitas-M small molecule compound

1-ethyl-2,3,3-trimethyl-3H-indolium

Catalog ID
STK396285
SMILES CC[N+]1=C(C)C(c2c1cccc2)(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 C13H18N MW 188.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N/c1-5-14-10(2)13(3,4)11-8-6-7-9-12(11)14/h6-9H,5H2,1-4H3/q+1
InChIKey
BWMDIXROHZDVFT-UHFFFAOYSA-N
Synonyms

1ETHYL233TRIMETHYL3HINDOLE1IUM
1ETHYL233TRIMETHYL3HINDOLE3IUM
1ethyl233trimethyl3Hindolium
1ETHYL233TRIMETHYLINDOL1IUM
CC(N+)1=C(C(C2=CC=CC=C21)(C)C)C
CC(N+)1=C(C)C(c2c1cccc2)(C)C
InChI=1SC13H18Nc151410(2)13(34)11867912(11)14h69H5H214H3q+1
MFCD00602813
ZINC000003131100
ZINC03131100
ZINC3131100

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Available files

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