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3-(o-Bromophenyl)-2-[N-(3-methylbutenyl)-N-benzylamino]propanenitrile
SpectraBase Compound ID 78ZHfuZUirN
InChI InChI=1S/C21H23BrN2/c1-17(2)12-13-24(16-18-8-4-3-5-9-18)20(15-23)14-19-10-6-7-11-21(19)22/h3-13,17,20H,14,16H2,1-2H3/b13-12+
InChIKey LBTMKQOSJAZXBM-OUKQBFOZSA-N
Mol Weight 383.33 g/mol
Molecular Formula C21H23BrN2
Exact Mass 382.104462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pPboIdfVqy
Name 3-(o-Bromophenyl)-2-[N-(3-methylbutenyl)-N-benzylamino]propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23BrN2
InChI InChI=1S/C21H23BrN2/c1-17(2)12-13-24(16-18-8-4-3-5-9-18)20(15-23)14-19-10-6-7-11-21(19)22/h3-13,17,20H,14,16H2,1-2H3/b13-12+
InChIKey LBTMKQOSJAZXBM-OUKQBFOZSA-N
Molecular Weight 383.333 g/mol
SMILES C(\C=C\N(C(C#N)Cc1c(Br)cccc1)Cc1ccccc1)(C)C
SPLASH splash10-0ftf-9272000000-729f3df4cfa6b58374e4
Source of Spectrum KC-0-2848-8
Synonyms 2-{benzyl[(1E)-3-methyl-1-butenyl]amino}-3-(2-bromophenyl)propanenitrile
Wiley ID 823407