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Isobrassinin

View entire compound with spectra: 1 MS (GC)

Isobrassinin
SpectraBase Compound ID 39rc7mamxdD
InChI InChI=1S/C11H12N2S2/c1-15-11(14)12-7-9-6-8-4-2-3-5-10(8)13-9/h2-6,13H,7H2,1H3,(H,12,14)
InChIKey XXVHTDZCNVORLP-UHFFFAOYSA-N
Mol Weight 236.35 g/mol
Molecular Formula C11H12N2S2
Exact Mass 236.044191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDkbim8MTtG
Name Isobrassinin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2S2
InChI InChI=1S/C11H12N2S2/c1-15-11(14)12-7-9-6-8-4-2-3-5-10(8)13-9/h2-6,13H,7H2,1H3,(H,12,14)
InChIKey XXVHTDZCNVORLP-UHFFFAOYSA-N
Molecular Weight 236.351 g/mol
SMILES [nH]1c2c(cc1CNC(=S)SC)cccc2
SPLASH splash10-001i-0910000000-d68897960e61caba0dc2
Source of Spectrum F5-4-700-43
Synonyms 2-[(N-Methylthio(thiocarbonyl)amino)methyl]-indole 2-[N-(Methylthio(thiocarbonyl)amino)methyl]-indole Methyl ((1H-indol-2-yl)methyl)carbamodithioate Methyl N-(1H-indol-2-ylmethyl)carbamodithioate
Wiley ID 1732729