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(Z)-3-[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]-4-(dimethylamino)but-3-en-2-one
SpectraBase Compound ID LlTjVA83Kh7
InChI InChI=1S/C13H14BrN5O/c1-9(20)12(8-18(2)3)13-15-16-17-19(13)11-6-4-10(14)5-7-11/h4-8H,1-3H3/b12-8+
InChIKey LTJFMDOCTWMNLK-XYOKQWHBSA-N
Mol Weight 336.19 g/mol
Molecular Formula C13H14BrN5O
Exact Mass 335.038173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tyXjnTJWi
Name (Z)-3-[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]-4-(dimethylamino)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrN5O
InChI InChI=1S/C13H14BrN5O/c1-9(20)12(8-18(2)3)13-15-16-17-19(13)11-6-4-10(14)5-7-11/h4-8H,1-3H3/b12-8+
InChIKey LTJFMDOCTWMNLK-XYOKQWHBSA-N
Molecular Weight 336.193 g/mol
SMILES c1([n](nnn1)-c1ccc(cc1)Br)\C(=C\N(C)C)C(=O)C
SPLASH splash10-000x-9200000000-be5d9034fcf320bb8e6d
Source of Spectrum Y-33-817-18
Synonyms (Z)-3-[1-(4-bromophenyl)-5-tetrazolyl]-4-(dimethylamino)-3-buten-2-one (Z)-3-[1-(4-bromophenyl)tetrazol-5-yl]-4-(dimethylamino)but-3-en-2-one
Wiley ID 1331496