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METHYL_13-CYANO-11-HYDROARTEMISINATE

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METHYL_13-CYANO-11-HYDROARTEMISINATE
SpectraBase Compound ID GNcDSbiAcxl
InChI InChI=1S/C17H25NO2/c1-11-4-6-13-12(2)5-7-14(16(13)10-11)15(8-9-18)17(19)20-3/h10,12-16H,4-8H2,1-3H3/t12-,13+,14+,15?,16+/m1/s1
InChIKey OOILRWKNFSZLKL-GDOYIGSPSA-N
Mol Weight 275.39 g/mol
Molecular Formula C17H25NO2
Exact Mass 275.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qIOu7CT9ba
Name 2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]-3-cyano-propionic acid methyl ester
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Formula C17H25NO2
InChI InChI=1S/C17H25NO2/c1-11-4-6-13-12(2)5-7-14(16(13)10-11)15(8-9-18)17(19)20-3/h10,12-16H,4-8H2,1-3H3/t12-,13+,14+,15?,16+/m1/s1
InChIKey OOILRWKNFSZLKL-GDOYIGSPSA-N
Molecular Weight 275.392 g/mol
SMILES [C@@]12([C@](C(C(=O)OC)CC#N)(CC[C@]([C@@]2(CCC(=C1)C)[H])(C)[H])[H])[H]
SPLASH splash10-03di-1900000000-cf58f838ac1a1c5e8362
Source of Spectrum G4-64-1203-4
Synonyms 2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]-3-cyanopropanoic acid methyl ester Methyl 2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]-3-cyano-propanoate
Wiley ID 1609207