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Acetic acid, 8-(2-cyanoethyl)-1,1,4a,7-tetramethyl-9-oxo-1,2,3,4,4a,4b,5,8,8a,9-decahydro-phenanthren-2-yl ester
SpectraBase Compound ID LJsLQ0i7bUl
InChI InChI=1S/C23H31NO3/c1-14-8-9-17-21(16(14)7-6-12-24)18(26)13-19-22(3,4)20(27-15(2)25)10-11-23(17,19)5/h8,13,16-17,20-21H,6-7,9-11H2,1-5H3
InChIKey BILLNZABSIFFCV-UHFFFAOYSA-N
Mol Weight 369.51 g/mol
Molecular Formula C23H31NO3
Exact Mass 369.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7X53SrqdyOs
Name Acetic acid, 8-(2-cyanoethyl)-1,1,4a,7-tetramethyl-9-oxo-1,2,3,4,4a,4b,5,8,8a,9-decahydro-phenanthren-2-yl ester
Alternate Name(s) 14-(2-Cyanoethyl)-13-methyl-7-oxopodocarpa-5,12-dien-3-yl acetate Acetic acid [8-(2-cyanoethyl)-1,1,4a,7-tetramethyl-9-oxo-3,4,4b,5,8,8a-hexahydro-2H-phenanthren-2-yl] ester [8-(2-cyanoethyl)-1,1,4a,7-tetramethyl-9-oxo-3,4,4b,5,8,8a-hexahydro-2H-phenanthren-2-yl] acetate [8-(2-cyanoethyl)-1,1,4a,7-tetramethyl-9-oxidanylidene-3,4,4b,5,8,8a-hexahydro-2H-phenanthren-2-yl] ethanoate
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Formula C23H31NO3
InChI InChI=1S/C23H31NO3/c1-14-8-9-17-21(16(14)7-6-12-24)18(26)13-19-22(3,4)20(27-15(2)25)10-11-23(17,19)5/h8,13,16-17,20-21H,6-7,9-11H2,1-5H3
InChIKey BILLNZABSIFFCV-UHFFFAOYSA-N
Molecular Weight 369.505 g/mol
SMILES CC1(C(OC(=O)C)CCC2(C1=CC(C1C2CC=C(C1CCC#N)C)=O)C)C
SPLASH splash10-014l-5934000000-8d55be4167bea8757943
Wiley ID 1479977