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(E)-Ethyl 3'-bromo-2'-methyl-6-(pyrrolidin-1-yldiazenyl)-[1,1'-biphenyl]-3-carboxylate
SpectraBase Compound ID 5kcgWsEi70R
InChI InChI=1S/C20H22BrN3O2/c1-3-26-20(25)15-9-10-19(22-23-24-11-4-5-12-24)17(13-15)16-7-6-8-18(21)14(16)2/h6-10,13H,3-5,11-12H2,1-2H3/b23-22+
InChIKey IOCJULQFQIKZMX-GHVJWSGMSA-N
Mol Weight 416.32 g/mol
Molecular Formula C20H22BrN3O2
Exact Mass 415.08954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPpcezcyuHj
Name (E)-Ethyl 3'-bromo-2'-methyl-6-(pyrrolidin-1-yldiazenyl)-[1,1'-biphenyl]-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22BrN3O2
InChI InChI=1S/C20H22BrN3O2/c1-3-26-20(25)15-9-10-19(22-23-24-11-4-5-12-24)17(13-15)16-7-6-8-18(21)14(16)2/h6-10,13H,3-5,11-12H2,1-2H3/b23-22+
InChIKey IOCJULQFQIKZMX-GHVJWSGMSA-N
Literature Reference DOI 10.1021/jo501640d
Molecular Weight 416.319 g/mol
SMILES c1c(\N=N\N2CCCC2)c(cc(c1)C(=O)OCC)-c1c(c(ccc1)Br)C
SPLASH splash10-014i-0930000000-4390f99c5b96e3d38d41
Source of Spectrum J-79-9213-1r
Wiley ID 1748206