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(1R,4aR,8R,8aR)-8-(aminomethyl)-4a-methyl-8-(phenylmethoxymethyl)-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-ol
SpectraBase Compound ID CAeDaDz0liO
InChI InChI=1S/C20H31NO2/c1-19-10-5-9-17(22)18(19)20(14-21,12-6-11-19)15-23-13-16-7-3-2-4-8-16/h2-4,7-8,17-18,22H,5-6,9-15,21H2,1H3/t17-,18-,19+,20-/m1/s1
InChIKey XEUDKHXDYJSKPG-YSTOQKLRSA-N
Mol Weight 317.47 g/mol
Molecular Formula C20H31NO2
Exact Mass 317.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CqgX8r3kIXG
Name (1R,4aR,8R,8aR)-8-(aminomethyl)-4a-methyl-8-(phenylmethoxymethyl)-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-ol
Comments Less than 3 mono-isotopic peaks
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Formula C20H31NO2
InChI InChI=1S/C20H31NO2/c1-19-10-5-9-17(22)18(19)20(14-21,12-6-11-19)15-23-13-16-7-3-2-4-8-16/h2-4,7-8,17-18,22H,5-6,9-15,21H2,1H3/t17-,18-,19+,20-/m1/s1
InChIKey XEUDKHXDYJSKPG-YSTOQKLRSA-N
Molecular Weight 317.473 g/mol
SMILES O[C@@]1(CCC[C@@]2([C@@]1([C@@](CN)(CCC2)COCc1ccccc1)[H])C)[H]
SPLASH splash10-0006-9000000000-fbdd158e4dea407dfba3
Source of Spectrum F-57-132-26
Synonyms (1R,4aR,8R,8aR)-8-(aminomethyl)-8-(benzoxymethyl)-4a-methyl-decalin-1-ol (1R,4aR,8R,8aR)-8-(aminomethyl)-8-(benzyloxymethyl)-4a-methyl-decalin-1-ol
Wiley ID 1549047