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1-Methoxyoxobrassinin
SpectraBase Compound ID GHHLfZMA8d1
InChI InChI=1S/C12H12N2O2S2/c1-16-14-7-9(11(15)13-12(17)18-2)8-5-3-4-6-10(8)14/h3-7H,1-2H3,(H,13,15,17)
InChIKey YKIXHHLHIWQBFW-UHFFFAOYSA-N
Mol Weight 280.36 g/mol
Molecular Formula C12H12N2O2S2
Exact Mass 280.03402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1POvIu3PgTj
Name 1-Methoxyoxobrassinin
Appearance Light yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O2S2
InChI InChI=1S/C12H12N2O2S2/c1-16-14-7-9(11(15)13-12(17)18-2)8-5-3-4-6-10(8)14/h3-7H,1-2H3,(H,13,15,17)
InChIKey YKIXHHLHIWQBFW-UHFFFAOYSA-N
Instrument Name Finigan SSQ 700
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.809
Molecular Weight 280.360 g/mol
SMILES N(C(c1c2ccccc2[n](c1)OC)=O)C(SC)=S
SPLASH splash10-00dj-1920000000-fbef016f4ad3dcffae9e
Source of Spectrum ARK-2008-99-25
Thin-Layer Chromatography Rf = 0, 46 (hexane/ethyl acetate, 3:1)
Wiley ID 1869557