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(2S)-2-[[(1S)-1-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)ethyl]amino]-2-phenyl-ethanol
SpectraBase Compound ID FopBpN1Iggc
InChI InChI=1S/C25H27NO5/c1-28-22-10-8-17(13-24(22)29-2)12-20(19-9-11-23-25(14-19)31-16-30-23)26-21(15-27)18-6-4-3-5-7-18/h3-11,13-14,20-21,26-27H,12,15-16H2,1-2H3/t20-,21+/m0/s1
InChIKey KMVAPOGSTLKWCD-LEWJYISDSA-N
Mol Weight 421.49 g/mol
Molecular Formula C25H27NO5
Exact Mass 421.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMONIckPjEf
Name (2S)-2-[[(1S)-1-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)ethyl]amino]-2-phenyl-ethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO5
InChI InChI=1S/C25H27NO5/c1-28-22-10-8-17(13-24(22)29-2)12-20(19-9-11-23-25(14-19)31-16-30-23)26-21(15-27)18-6-4-3-5-7-18/h3-11,13-14,20-21,26-27H,12,15-16H2,1-2H3/t20-,21+/m0/s1
InChIKey KMVAPOGSTLKWCD-LEWJYISDSA-N
Molecular Weight 421.493 g/mol
SMILES N([C@](c1cc2OCOc2cc1)(Cc1cc(OC)c(cc1)OC)[H])[C@](CO)(c1ccccc1)[H]
SPLASH splash10-0fk9-0590000000-e81a5319fe114c064f1c
Source of Spectrum J-62-6719-3
Wiley ID 1378337