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(1S,RS)-N-tert-Butanesulfinyl-1-(4-methoxyphenyl)but-3-en-1-amine
SpectraBase Compound ID 3jsoTSuCMxL
InChI InChI=1S/C15H23NO2S/c1-6-7-14(16-19(17)15(2,3)4)12-8-10-13(18-5)11-9-12/h6,8-11,14,16H,1,7H2,2-5H3/t14-,19?/m0/s1
InChIKey HZUJBJCKTJUSOB-KTQQKIMGSA-N
Mol Weight 281.41 g/mol
Molecular Formula C15H23NO2S
Exact Mass 281.14495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37izpIxqgvQ
Name (S(S))-N-[(S)-1-(4-Methoxyphenyl)but-3-en-1yl]-2-methylpropane-2-sulfinamide
Appearance Yellow oil
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Formula C15H23NO2S
InChI InChI=1S/C15H23NO2S/c1-6-7-14(16-19(17)15(2,3)4)12-8-10-13(18-5)11-9-12/h6,8-11,14,16H,1,7H2,2-5H3/t14-,19?/m0/s1
InChIKey HZUJBJCKTJUSOB-KTQQKIMGSA-N
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202001142
Molecular Weight 281.414 g/mol
Reported Formula C15H23NO2S
SMILES N([C@](c1ccc(cc1)OC)(CC=C)[H])[S@](C(C)(C)C)=O
SPLASH splash10-001r-0910000000-65f0ee989465dc9cf611
Source of Spectrum CSC-13-SM13-(S(S),S)-2n
Thin-Layer Chromatography Rf = 0.32 (hexane/EtOAc, 1:2)
Wiley ID 1840045