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(2S,3R,8aS)-5-[(1-Benzyloxy)methyl]-1-(4-methoxybenzyl)-2-methyl-1,2,3,7,8,8a-hexahydroquinolin-3-ol
SpectraBase Compound ID 8bZ5y3yvfLw
InChI InChI=1S/C26H31NO3/c1-19-26(28)15-24-22(18-30-17-21-7-4-3-5-8-21)9-6-10-25(24)27(19)16-20-11-13-23(29-2)14-12-20/h3-5,7-9,11-15,19,25-26,28H,6,10,16-18H2,1-2H3/t19-,25-,26+/m0/s1
InChIKey FGWRSTDEFOJEJI-RRWZXMNXSA-N
Mol Weight 405.54 g/mol
Molecular Formula C26H31NO3
Exact Mass 405.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgpEYIjCG4R
Name (2S,3R,8aS)-5-[(1-Benzyloxy)methyl]-1-(4-methoxybenzyl)-2-methyl-1,2,3,7,8,8a-hexahydroquinolin-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31NO3
InChI InChI=1S/C26H31NO3/c1-19-26(28)15-24-22(18-30-17-21-7-4-3-5-8-21)9-6-10-25(24)27(19)16-20-11-13-23(29-2)14-12-20/h3-5,7-9,11-15,19,25-26,28H,6,10,16-18H2,1-2H3/t19-,25-,26+/m0/s1
InChIKey FGWRSTDEFOJEJI-RRWZXMNXSA-N
Molecular Weight 405.538 g/mol
SMILES O[C@@]1(C=C2[C@@](N([C@]1(C)[H])Cc1ccc(cc1)OC)(CCC=C2COCc1ccccc1)[H])[H]
SPLASH splash10-00di-2900000000-cd11cfd7578559e344e5
Source of Spectrum J-73-3092-4
Synonyms (2S,3R,8aS)-5-(benzyloxymethyl)-1-[(4-methoxyphenyl)methyl]-2-methyl-3,7,8,8a-tetrahydro-2H-quinolin-3-ol (2S,3R,8aS)-1-[(4-methoxyphenyl)methyl]-2-methyl-5-(phenylmethoxymethyl)-3,7,8,8a-tetrahydro-2H-quinolin-3-ol
Wiley ID 1668216