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(R(S))-N-(tert-Butanesulfinyl)-3-(4-methoxyphenyl)propan-1-imine
SpectraBase Compound ID 51Kgx1SjSWZ
InChI InChI=1S/C14H21NO2S/c1-14(2,3)18(16)15-11-5-6-12-7-9-13(17-4)10-8-12/h7-11H,5-6H2,1-4H3
InChIKey AFVJWSSNAYCQPM-UHFFFAOYSA-N
Mol Weight 267.39 g/mol
Molecular Formula C14H21NO2S
Exact Mass 267.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMX1SPSVcyP
Name (R(S))-N-(tert-Butanesulfinyl)-3-(4-methoxyphenyl)propan-1-imine
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.129300092 u
Formula C14H21NO2S
InChI InChI=1S/C14H21NO2S/c1-14(2,3)18(16)15-11-5-6-12-7-9-13(17-4)10-8-12/h7-11H,5-6H2,1-4H3
InChIKey AFVJWSSNAYCQPM-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800111
Molecular Weight 267.387 g/mol
Optical Rotation [a]D23 = -140 (c = 1, CH2Cl2)
Quality 91
Reported Formula C14H21NO2S
SMILES C=1(CCC=N[S@@](C(C)(C)C)=O)C=CC(=CC1)OC
SPLASH splash10-00di-4910000000-3d5df6b898973d6b8205
Source of Spectrum K1-2018-2613-4h (DOI: 10.1002/ejoc.201800111)
Thin-Layer Chromatography 0.70 (hexane/EtOAc, 1:1)
Wiley ID 1894046