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(E)-2-(2-(2-(4-Bromophenyl)-2-oxoethyl)-2H-tetrazol-5-yl)-3-(o-tolyl)acrylonitrile
SpectraBase Compound ID 3Be8bgJWvjw
InChI InChI=1S/C19H14BrN5O/c1-13-4-2-3-5-15(13)10-16(11-21)19-22-24-25(23-19)12-18(26)14-6-8-17(20)9-7-14/h2-10H,12H2,1H3/b16-10+
InChIKey ACRFKKZIZJQDIT-MHWRWJLKSA-N
Mol Weight 408.26 g/mol
Molecular Formula C19H14BrN5O
Exact Mass 407.038173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cwCSPCqomw
Name (E)-2-(2-(2-(4-Bromophenyl)-2-oxoethyl)-2H-tetrazol-5-yl)-3-(o-tolyl)acrylonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14BrN5O
InChI InChI=1S/C19H14BrN5O/c1-13-4-2-3-5-15(13)10-16(11-21)19-22-24-25(23-19)12-18(26)14-6-8-17(20)9-7-14/h2-10H,12H2,1H3/b16-10+
InChIKey ACRFKKZIZJQDIT-MHWRWJLKSA-N
Literature Reference DOI 10.1515/znb-2015-0070
Molecular Weight 408.259 g/mol
SMILES C(\C(=C/c1c(cccc1)C)c1nn[n](n1)CC(=O)c1ccc(cc1)Br)#N
SPLASH splash10-0544-0900000000-0253fc9cdad7a85ada9a
Source of Spectrum ZNB-70-826-4b
Wiley ID 1803358