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(1S,2S,RS)-N-tert-Butanesulfinyl-1-(4-methoxyphenyl)-2-methylbut-3-en-1-amine
SpectraBase Compound ID JjqhCOwylcD
InChI InChI=1S/C16H25NO2S/c1-7-12(2)15(17-20(18)16(3,4)5)13-8-10-14(19-6)11-9-13/h7-12,15,17H,1H2,2-6H3/t12-,15-,20?/m0/s1
InChIKey PNZIAIQRWZAGRJ-ISCRRKANSA-N
Mol Weight 295.44 g/mol
Molecular Formula C16H25NO2S
Exact Mass 295.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uUGNB0URk
Name (1S,2S,RS)-N-tert-Butanesulfinyl-1-(4-methoxyphenyl)-2-methylbut-3-en-1-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO2S
InChI InChI=1S/C16H25NO2S/c1-7-12(2)15(17-20(18)16(3,4)5)13-8-10-14(19-6)11-9-13/h7-12,15,17H,1H2,2-6H3/t12-,15-,20?/m0/s1
InChIKey PNZIAIQRWZAGRJ-ISCRRKANSA-N
Literature Reference DOI 10.1039/c4cc02317j
Molecular Weight 295.441 g/mol
SMILES N([C@](c1ccc(cc1)OC)([C@](C=C)(C)[H])[H])[S@@](C(C)(C)C)=O
SPLASH splash10-00m0-0910000000-dbdf8f2dc7d220c5ee69
Source of Spectrum KD-50-6898/SM11-3s
Synonyms (R)-N-((1S,2S)-1-(4-methoxyphenyl)-2-methylbut-3-en-1-yl)-2-methylpropane-2-sulfinamide
Wiley ID 1754695