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(4R,RS)-N-(tert-Butanesulfinyl)-1-(trimethylsilyl)tridec-1-yn-4-amine
SpectraBase Compound ID 81KD2NqR0Ko
InChI InChI=1S/C20H41NOSSi/c1-8-9-10-11-12-13-14-16-19(17-15-18-24(5,6)7)21-23(22)20(2,3)4/h19,21H,8-14,16-17H2,1-7H3/t19-,23?/m1/s1
InChIKey QEZCJVWPMVOIGE-HWYAHNCWSA-N
Mol Weight 371.7 g/mol
Molecular Formula C20H41NOSSi
Exact Mass 371.267813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gF3ELyVckg
Name (4R,RS)-N-(tert-Butanesulfinyl)-1-(trimethylsilyl)tridec-1-yn-4-amine
Appearance Yellow oil
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Formula C20H41NOSSi
InChI InChI=1S/C20H41NOSSi/c1-8-9-10-11-12-13-14-16-19(17-15-18-24(5,6)7)21-23(22)20(2,3)4/h19,21H,8-14,16-17H2,1-7H3/t19-,23?/m1/s1
InChIKey QEZCJVWPMVOIGE-HWYAHNCWSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901590
Molecular Weight 371.699 g/mol
Optical Rotation [a]20D = ??6.2 (c = 1.10, CH2Cl2)
Reported Formula C20H41NOSSi
SMILES N([C@](CCCCCCCCC)(CC#C[Si](C)(C)C)[H])[S@](=O)C(C)(C)C
SPLASH splash10-0aor-9570000000-59fc3983797c9f5b7662
Sample Comments Diastereomeric mixture (1:1)
Source of Spectrum U1-2020-119-2d
Thin-Layer Chromatography Rf = 0.26 (hexane/EtOAc, 4:1)
Wiley ID 1856924