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(4R)-N-(tert-Butanesulfonyl)-N-(2-propyl)-2-methylhept-6-yn-4-amine
SpectraBase Compound ID 8S9jdzFznY7
InChI InChI=1S/C15H25NO2S/c1-8-10-14(12-13(3)4)16(11-9-2)19(17,18)15(5,6)7/h1-2,13-14H,10-12H2,3-7H3/t14-/m0/s1
InChIKey OVTZEUJKVDMBJN-AWEZNQCLSA-N
Mol Weight 283.43 g/mol
Molecular Formula C15H25NO2S
Exact Mass 283.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ulYrsvKRk
Name (4R)-N-(tert-Butanesulfonyl)-N-(2-propyl)-2-methylhept-6-yn-4-amine
Appearance Yellow oil
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Formula C15H25NO2S
InChI InChI=1S/C15H25NO2S/c1-8-10-14(12-13(3)4)16(11-9-2)19(17,18)15(5,6)7/h1-2,13-14H,10-12H2,3-7H3/t14-/m0/s1
InChIKey OVTZEUJKVDMBJN-AWEZNQCLSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901590
Molecular Weight 283.430 g/mol
Optical Rotation [a]20D = +3.8 (c = 0.96, CH2Cl2)
Reported Formula C15H25NO2S
SMILES C([C@@](N(S(C(C)(C)C)(=O)=O)CC#C)(CC#C)[H])C(C)C
SPLASH splash10-006x-9700000000-8b0a33572625050dbb6b
Source of Spectrum U1-2020-121-5c
Thin-Layer Chromatography Rf = 0.58 (hexane/EtOAc, 5:1)
Wiley ID 1856935