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(R(S))-N-(tert-Butanesulfinyl)-4-(2-bromophenyl)butan-1-imine
SpectraBase Compound ID F1PBPrSjNjQ
InChI InChI=1S/C14H20BrNOS/c1-14(2,3)18(17)16-11-7-6-9-12-8-4-5-10-13(12)15/h4-5,8,10-11H,6-7,9H2,1-3H3
InChIKey HZJKGGBWMXOWJP-UHFFFAOYSA-N
Mol Weight 330.28 g/mol
Molecular Formula C14H20BrNOS
Exact Mass 329.044898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAHsNdhlzk2
Name (R(S))-N-(tert-Butanesulfinyl)-4-(2-bromophenyl)butan-1-imine
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20BrNOS
InChI InChI=1S/C14H20BrNOS/c1-14(2,3)18(17)16-11-7-6-9-12-8-4-5-10-13(12)15/h4-5,8,10-11H,6-7,9H2,1-3H3
InChIKey HZJKGGBWMXOWJP-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800111
Molecular Weight 330.284 g/mol
Optical Rotation [a]D23 = -94 (c = 1, CH2Cl2)
Quality 345
SMILES C(CCC=N[S@@](C(C)(C)C)=O)C1=CC=CC=C1Br
SPLASH splash10-00xu-2910000000-50fe8e3d30537f4bfb3b
Source of Spectrum K1-2018-2613-4l (DOI: 10.1002/ejoc.201800111)
Thin-Layer Chromatography 0.78 (hexane/EtOAc, 1:1)
Wiley ID 1894050