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(E)-Ethyl 2'-(trideuteromethyl)-6-(pyrrolidin-1-yldiazenyl)-[1,1'-biphenyl]-3-carboxylate
SpectraBase Compound ID DrXVyLgxvkv
InChI InChI=1S/C20H23N3O2/c1-3-25-20(24)16-10-11-19(21-22-23-12-6-7-13-23)18(14-16)17-9-5-4-8-15(17)2/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3/b22-21+/i2D3
InChIKey XDBCTGMBVMGOEQ-BFISYZDRSA-N
Mol Weight 340.44 g/mol
Molecular Formula C20H20D3N3O2
Exact Mass 340.197857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2J2It5x820X
Name (E)-Ethyl 2'-(trideuteromethyl)-6-(pyrrolidin-1-yldiazenyl)-[1,1'-biphenyl]-3-carboxylate
Alternate Name(s) Ethyl 3-[2-trideuteromethylphenyl]-4-[(E)-2-(pyrrolidin-1-yl)diazen-1-yl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20D3N3O2
InChI InChI=1S/C20H23N3O2/c1-3-25-20(24)16-10-11-19(21-22-23-12-6-7-13-23)18(14-16)17-9-5-4-8-15(17)2/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3/b22-21+/i2D3
InChIKey XDBCTGMBVMGOEQ-BFISYZDRSA-N
Literature Reference DOI 10.1021/jo501640d
Molecular Weight 340.441 g/mol
SMILES C([D])(c1ccccc1-c1cc(C(OCC)=O)ccc1\N=N\N1CCCC1)([D])[D]
SPLASH splash10-00xr-1900000000-3e4f27989b3ac387b64b
Source of Spectrum J-79-9217-1a_d3
Wiley ID 1748186