Vitas-M small molecule compound
3,3'-(6,6-dimethyl-4-oxotetrahydro-2H-pyran-3,3-diyl)dipropanenitrile
Catalog ID
STK525341
SMILES N#CCCC1(CCC#N)COC(CC1=O)(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 C13H18N2O2 MW 234.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N2O2/c1-12(2)9-11(16)13(10-17-12,5-3-7-14)6-4-8-15/h3-6,9-10H2,1-2H3InChIKey
JXGSJDRBMKSXKD-UHFFFAOYSA-NSynonyms
95234-66-52HPYRAN33(4H)DIPROPANENITRILEDIHYDRO66DIMETHYL4OXO
3(3(2CYANOETHYL)66DIMETHYL4OXOOXAN3YL)PROPANENITRILE
33(66dimethyl4oxotetrahydro2Hpyran33diyl)dipropanenitrile
95234665
CC1(CC(=O)C(CO1)(CCC#N)CCC#N)C
InChI=1SC13H18N2O2c112(2)911(16)13(10171253714)64815h36910H212H3
ZINC000002278748
ZINC02278748
ZINC2278748
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