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L-TRYPTOPHYL-THIOHYDANTOIN
SpectraBase Compound ID DaDtRAODiqz
InChI InChI=1S/C12H11N3OS/c16-11-10(14-12(17)15-11)5-7-6-13-9-4-2-1-3-8(7)9/h1-4,6,10,13H,5H2,(H2,14,15,16,17)
InChIKey MPLRRPKKFHUEEL-UHFFFAOYSA-N
Mol Weight 245.3 g/mol
Molecular Formula C12H11N3OS
Exact Mass 245.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcKNXYJ9Gzc
Name 5-(1H-Indol-3-ylmethyl)-2-thioxo-4-imidazolidinone
Alternate Name(s) 5-(1H-indol-3-ylmethyl)-2-sulfanylidene-4-imidazolidinone 5-(1H-indol-3-ylmethyl)-2-sulfanylidene-imidazolidin-4-one 5-(1H-indol-3-ylmethyl)-2-thioxo-imidazolidin-4-one 5-(Indole-3-yl)methyl-2-thioxo-imidazolidin-4-one
CAS Registry Number 61159-99-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3OS
InChI InChI=1S/C12H11N3OS/c16-11-10(14-12(17)15-11)5-7-6-13-9-4-2-1-3-8(7)9/h1-4,6,10,13H,5H2,(H2,14,15,16,17)
InChIKey MPLRRPKKFHUEEL-UHFFFAOYSA-N
Molecular Weight 245.300 g/mol
SMILES [nH]1c2ccccc2c(CC2N=C(NC2=O)S)c1
SPLASH splash10-001i-1900000000-b71a58a2bec07f8d907c
Source of Spectrum O-11-560-6
Wiley ID 1247855