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(S)-2-((2-Methoxyethoxy)(4-methoxyphenyl)methyl)-N-methylaniline
SpectraBase Compound ID KfcnI6Ubi7i
InChI InChI=1S/C18H23NO3/c1-19-17-7-5-4-6-16(17)18(22-13-12-20-2)14-8-10-15(21-3)11-9-14/h4-11,18-19H,12-13H2,1-3H3/t18-/m0/s1
InChIKey YAUIDJSSWCJMMP-SFHVURJKSA-N
Mol Weight 301.39 g/mol
Molecular Formula C18H23NO3
Exact Mass 301.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zFRJfBWdDI
Name (S)-2-((2-Methoxyethoxy)(4-methoxyphenyl)methyl)-N-methylaniline
Appearance Colorless oil
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Exact Mass 301.167793602 u
Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-19-17-7-5-4-6-16(17)18(22-13-12-20-2)14-8-10-15(21-3)11-9-14/h4-11,18-19H,12-13H2,1-3H3/t18-/m0/s1
InChIKey YAUIDJSSWCJMMP-SFHVURJKSA-N
Instrument Name Shimadzu GC-MS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201511179
Molecular Weight 301.386 g/mol
Optical Rotation [a]D(RT) = +36.6 (c = 0.7, CHCl3)
Quality 175
Reported Formula C18H23NO3
SMILES N(C1=C(C=CC=C1)[C@](C=1C=CC(=CC1)OC)(OCCOC)[H])C
SPLASH splash10-0229-1091000000-65996d6847ecd418d568
Sample Comments 71% ee
Source of Spectrum ACI-55-SM22-3q (DOI: 10.1002/anie.201511179)
Wiley ID 1897300