Vitas-M small molecule compound
1-methyl-3-oxo-1-phenyl-2-oxaspiro[4.5]decane-4-carbonitrile
Catalog ID
STL328878
SMILES N#CC1C(=O)OC(C21CCCCC2)(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 C17H19NO2 MW 269.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO2/c1-16(13-8-4-2-5-9-13)17(10-6-3-7-11-17)14(12-18)15(19)20-16/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3InChIKey
IBWRSXPLRFQYDT-UHFFFAOYSA-NSynonyms
331962-04-01methyl3oxo1phenyl2oxaspiro(45)decane4carbonitrile
331962040
4METHYL2OXO4PHENYL3OXASPIRO(45)DECANE1CARBONITRILE
4METHYL2OXO4PHENYL3OXASPIRO(45)DECANECARBONITRILE
CC1(C2(CCCCC2)C(C(=O)O1)C#N)C3=CC=CC=C3
InChI=1SC17H19NO2c116(138425913)17(106371117)14(1218)15(19)2016h2458914H3671011H21H3
MFCD00421460
OXOLANE3CARBONITRILE5METHYL2OXO5PHENYL4SPIROCYCLOHEXANE
ZINC000000289522
ZINC000000289526
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