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2-Hydroxy-2-(12''-methoxypodocarpa-8'',11'',13''-trien-14''-yl)propanenitrile

View entire compound with spectra: 1 MS (GC)

2-Hydroxy-2-(12''-methoxypodocarpa-8'',11'',13''-trien-14''-yl)propanenitrile
SpectraBase Compound ID 5TGe3VTVwmH
InChI InChI=1S/C20H27NO2/c1-13-6-5-9-19(2)16(13)8-7-15-17(19)10-14(23-4)11-18(15)20(3,22)12-21/h10-11,13,16,22H,5-9H2,1-4H3
InChIKey DDNRRAXWSCLUSV-UHFFFAOYSA-N
Mol Weight 313.44 g/mol
Molecular Formula C20H27NO2
Exact Mass 313.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WCy8gEsoZA
Name 2-Hydroxy-2-(12''-methoxypodocarpa-8'',11'',13''-trien-14''-yl)propanenitrile
Alternate Name(s) 2-Hydroxy-2-(12''-methoxypodocarpa-8'',11'',13''-trien-14''-yl)propanenitrile 2-Hydroxy-2-(3-methoxy-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydro-1-phenanthrenyl)propanenitrile
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Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-13-6-5-9-19(2)16(13)8-7-15-17(19)10-14(23-4)11-18(15)20(3,22)12-21/h10-11,13,16,22H,5-9H2,1-4H3
InChIKey DDNRRAXWSCLUSV-UHFFFAOYSA-N
Molecular Weight 313.441 g/mol
SMILES OC(c1c2c(C3(C(C(C)CCC3)CC2)C)cc(c1)OC)(C#N)C
SPLASH splash10-0002-0490000000-52ddd8f4c02e9f160b23
Source of Spectrum B-46-1825-0
Wiley ID 1314434