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5-{2-[2-(p-methylphenyl)-indol-3-yl]-ethenyl}(3-methyl-4-amino)isoxazole
SpectraBase Compound ID CadBaaTgKMp
InChI InChI=1S/C21H19N3O/c1-13-7-9-15(10-8-13)21-17(16-5-3-4-6-18(16)23-21)11-12-19-20(22)14(2)24-25-19/h3-12,23H,22H2,1-2H3/b12-11+
InChIKey UMDVCDZOUDEQQM-VAWYXSNFSA-N
Mol Weight 329.4 g/mol
Molecular Formula C21H19N3O
Exact Mass 329.152812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jb5plScjJd
Name 5-{2-[2-(p-methylphenyl)-indol-3-yl]-ethenyl}(3-methyl-4-amino)isoxazole
Alternate Name(s) 3-Methyl-5-{(E)-2-[2-(4-methylphenyl)-1H-indol-3-yl]ethenyl}-4-isoxazolamine 3-Methyl-5-{(E)-2-[2-(4-methylphenyl)-1H-indol-3-yl]ethenyl}-4-isoxazolylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O
InChI InChI=1S/C21H19N3O/c1-13-7-9-15(10-8-13)21-17(16-5-3-4-6-18(16)23-21)11-12-19-20(22)14(2)24-25-19/h3-12,23H,22H2,1-2H3/b12-11+
InChIKey UMDVCDZOUDEQQM-VAWYXSNFSA-N
Molecular Weight 329.403 g/mol
SMILES Nc1c(\C=C\c2c([nH]c3ccccc23)-c2ccc(cc2)C)onc1C
SPLASH splash10-0929-0092000000-f6f9a0f918dc68697177
Source of Spectrum O-27-901-0
Wiley ID 1327276