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trans-(??)-1-Methoxyspirobrassinol isopropyl ether
SpectraBase Compound ID GBHciZ4Ogul
InChI InChI=1S/C15H20N2O2S2/c1-10(2)19-13-15(9-16-14(20-4)21-15)11-7-5-6-8-12(11)17(13)18-3/h5-8,10,13H,9H2,1-4H3/t13-,15+/m1/s1
InChIKey QFHOHCYWFIOAAF-HIFRSBDPSA-N
Mol Weight 324.46 g/mol
Molecular Formula C15H20N2O2S2
Exact Mass 324.09662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjsxiHxY6eC
Name trans-(??)-1-Methoxyspirobrassinol isopropyl ether
Appearance Bright yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20N2O2S2
InChI InChI=1S/C15H20N2O2S2/c1-10(2)19-13-15(9-16-14(20-4)21-15)11-7-5-6-8-12(11)17(13)18-3/h5-8,10,13H,9H2,1-4H3/t13-,15+/m1/s1
InChIKey QFHOHCYWFIOAAF-HIFRSBDPSA-N
Instrument Name GS-MS Trio 1000 Fisons
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p009.958
Molecular Weight 324.457 g/mol
SMILES c12N([C@@]([C@@]3(c2cccc1)CN=C(S3)SC)(OC(C)C)[H])OC
SPLASH splash10-0f6x-7490000000-f99d9fa74bb9c4653c95
Source of Spectrum ARK-2016-219-trans-(??)-8a
Thin-Layer Chromatography Rf = 0.59 (n-hexane/Me2CO 5:1)
Wiley ID 1840846