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(-)-4-Thiostenine
SpectraBase Compound ID KxsAt45u1fm
InChI InChI=1S/C17H25NO2S/c1-3-10-11-5-4-6-13(21)18-8-7-12(15(11)18)14-9(2)17(19)20-16(10)14/h9-12,14-16H,3-8H2,1-2H3/t9-,10+,11+,12+,14+,15+,16-/m0/s1
InChIKey RRCRUCLJXQLEQK-BKQRAYJDSA-N
Mol Weight 307.45 g/mol
Molecular Formula C17H25NO2S
Exact Mass 307.1606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50YpaCtZQF2
Name (-)-4-Thiostenine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO2S
InChI InChI=1S/C17H25NO2S/c1-3-10-11-5-4-6-13(21)18-8-7-12(15(11)18)14-9(2)17(19)20-16(10)14/h9-12,14-16H,3-8H2,1-2H3/t9-,10+,11+,12+,14+,15+,16-/m0/s1
InChIKey RRCRUCLJXQLEQK-BKQRAYJDSA-N
Molecular Weight 307.452 g/mol
SMILES [C@@]12(N3C(=S)CCC[C@@]2([C@]([C@@]2(OC([C@]([C@@]2([C@]1(CC3)[H])[H])(C)[H])=O)[H])(CC)[H])[H])[H]
SPLASH splash10-0a6r-2096000000-e082e77cf6aa36e7f55c
Source of Spectrum C-117-11112-35
Synonyms (7aR,8R,8aS,11S,11aS,11bR,11cR)-8-ethyl-11-methyl-4-thioxododecahydroazepino[3,2,1-hi]furo[3,2-e]indol-10(2H)-one
Wiley ID 759356