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(1S)-6-methoxy-1-[(2-methoxy-5-phenylmethoxy-phenyl)methyl]-2-[(1S)-1-phenylethyl]-7-phenylmethoxy-3,4-dihydro-1H-isoquinoline
SpectraBase Compound ID Dymu4hzMCzt
InChI InChI=1S/C40H41NO4/c1-29(32-17-11-6-12-18-32)41-22-21-33-25-39(43-3)40(45-28-31-15-9-5-10-16-31)26-36(33)37(41)24-34-23-35(19-20-38(34)42-2)44-27-30-13-7-4-8-14-30/h4-20,23,25-26,29,37H,21-22,24,27-28H2,1-3H3/t29-,37-/m0/s1
InChIKey SVLDBTCIGKVGPA-WLMPYFOXSA-N
Mol Weight 599.8 g/mol
Molecular Formula C40H41NO4
Exact Mass 599.303559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtZ4Lbw6BXH
Name (1S)-6-methoxy-1-[(2-methoxy-5-phenylmethoxy-phenyl)methyl]-2-[(1S)-1-phenylethyl]-7-phenylmethoxy-3,4-dihydro-1H-isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H41NO4
InChI InChI=1S/C40H41NO4/c1-29(32-17-11-6-12-18-32)41-22-21-33-25-39(43-3)40(45-28-31-15-9-5-10-16-31)26-36(33)37(41)24-34-23-35(19-20-38(34)42-2)44-27-30-13-7-4-8-14-30/h4-20,23,25-26,29,37H,21-22,24,27-28H2,1-3H3/t29-,37-/m0/s1
InChIKey SVLDBTCIGKVGPA-WLMPYFOXSA-N
Molecular Weight 599.771 g/mol
SMILES [C@@]1(N(CCc2cc(c(cc12)OCc1ccccc1)OC)[C@](c1ccccc1)(C)[H])(Cc1c(ccc(c1)OCc1ccccc1)OC)[H]
SPLASH splash10-05fr-4639000000-fbdd67f19726f7eb196c
Source of Spectrum H1-45-1118-13
Synonyms (1S)-7-benzoxy-1-(5-benzoxy-2-methoxy-benzyl)-6-methoxy-2-[(1S)-1-phenylethyl]-3,4-dihydro-1H-isoquinoline (1S)-7-benzyloxy-1-[(5-benzyloxy-2-methoxy-phenyl)methyl]-6-methoxy-2-[(1S)-1-phenylethyl]-3,4-dihydro-1H-isoquinoline
Wiley ID 758319