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1-BOC-isobrassinin
SpectraBase Compound ID 6pTYs8KFkd8
InChI InChI=1S/C16H20N2O2S2/c1-16(2,3)20-15(19)18-12(10-17-14(21)22-4)9-11-7-5-6-8-13(11)18/h5-9H,10H2,1-4H3,(H,17,21)
InChIKey MGMGIODJJVLFMQ-UHFFFAOYSA-N
Mol Weight 336.47 g/mol
Molecular Formula C16H20N2O2S2
Exact Mass 336.09662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D52RDM0aeWD
Name 1-BOC-isobrassinin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O2S2
InChI InChI=1S/C16H20N2O2S2/c1-16(2,3)20-15(19)18-12(10-17-14(21)22-4)9-11-7-5-6-8-13(11)18/h5-9H,10H2,1-4H3,(H,17,21)
InChIKey MGMGIODJJVLFMQ-UHFFFAOYSA-N
Molecular Weight 336.468 g/mol
SMILES N(C(=S)SC)Cc1[n](C(OC(C)(C)C)=O)c2c(cccc2)c1
SPLASH splash10-001i-0911000000-d7bf1046547008c29b1d
Source of Spectrum F5-4-700-44
Synonyms 1-(t-Butoxycarbonyl)-2-[(N-methylthio(thiocarbonyl)amino)methyl]-indole 1-(t-Butoxycarbonyl)-2-[N-(methylthio(thiocarbonyl)amino)methyl]-indole tert-Butyl 2-((((methylthio)carbonothioyl)amino)methyl)-1H-indole-1-carboxylate 2-[[[(methylthio)-sulfanylidenemethyl]amino]methyl]-1-indolecarboxylic acid tert-butyl ester tert-Butyl 2-[(methylsulfanylcarbothioylamino)methyl]indole-1-carboxylate
Wiley ID 1732728