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(S)-1-phenyl-2-(benzo[1,3]dioxol-5-yl)-ethylamine
SpectraBase Compound ID 4gS88KEnnYs
InChI InChI=1S/C15H15NO2/c16-13(12-4-2-1-3-5-12)8-11-6-7-14-15(9-11)18-10-17-14/h1-7,9,13H,8,10,16H2/t13-/m0/s1
InChIKey UYTHWQMJKBSROW-ZDUSSCGKSA-N
Mol Weight 241.29 g/mol
Molecular Formula C15H15NO2
Exact Mass 241.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTv6C9i8Rby
Name (S)-1-phenyl-2-(benzo[1,3]dioxol-5-yl)-ethylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO2
InChI InChI=1S/C15H15NO2/c16-13(12-4-2-1-3-5-12)8-11-6-7-14-15(9-11)18-10-17-14/h1-7,9,13H,8,10,16H2/t13-/m0/s1
InChIKey UYTHWQMJKBSROW-ZDUSSCGKSA-N
Ionization Type EI
Molecular Weight 241.290 g/mol
Optical Rotation [a]D20 = +20.8 (c = 1.0, CHCl3)
SMILES N[C@@](Cc1cc2OCOc2cc1)(c1ccccc1)[H]
SPLASH splash10-0a4i-0960000000-e7552266f96921c893ee
Sample Comments 100% ee
Source of Spectrum WO2010131274A1
Wiley ID 1844270