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1-Methoxy-isobrassinin

View entire compound with spectra: 1 MS (GC)

1-Methoxy-isobrassinin
SpectraBase Compound ID LUlBmHXrIUz
InChI InChI=1S/C12H14N2OS2/c1-15-14-10(8-13-12(16)17-2)7-9-5-3-4-6-11(9)14/h3-7H,8H2,1-2H3,(H,13,16)
InChIKey NNEJHKNYIVHPTC-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C12H14N2OS2
Exact Mass 266.054755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fufnJ6DMxB
Name 1-Methoxy-isobrassinin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2OS2
InChI InChI=1S/C12H14N2OS2/c1-15-14-10(8-13-12(16)17-2)7-9-5-3-4-6-11(9)14/h3-7H,8H2,1-2H3,(H,13,16)
InChIKey NNEJHKNYIVHPTC-UHFFFAOYSA-N
Molecular Weight 266.377 g/mol
SMILES N(C(=S)SC)Cc1[n](c2c(cccc2)c1)OC
SPLASH splash10-002r-0960000000-a080112868550489337c
Source of Spectrum F5-4-699-38
Synonyms 1-Methoxy-2-[(N-methylthio(thiocarbonyl)amino)methyl]-indole 1-Methoxy-2-[N-(methylthio(thiocarbonyl)amino)methyl]-indole Methyl ((1-methoxy-1H-indol-2-yl)methyl)carbamodithioate N-[(1-methoxy-2-indolyl)methyl]carbamodithioic acid methyl ester Methyl N-[(1-methoxyindol-2-yl)methyl]carbamodithioate
Wiley ID 1732732