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Ethyl-3-((E)-3-hydroxy-3-phenylprop-1-enyl)-4-((E)-pyrrolidin-1-yldiazenyl)benzoate
SpectraBase Compound ID LCbEAynaLAh
InChI InChI=1S/C22H25N3O3/c1-2-28-22(27)19-10-12-20(23-24-25-14-6-7-15-25)18(16-19)11-13-21(26)17-8-4-3-5-9-17/h3-5,8-13,16,21,26H,2,6-7,14-15H2,1H3/b13-11+,24-23+
InChIKey AFMIWTSHFGKSAX-YTQZXPMWSA-N
Mol Weight 379.46 g/mol
Molecular Formula C22H25N3O3
Exact Mass 379.189592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOYAFVItjV4
Name Ethyl-3-((E)-3-hydroxy-3-phenylprop-1-enyl)-4-((E)-pyrrolidin-1-yldiazenyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N3O3
InChI InChI=1S/C22H25N3O3/c1-2-28-22(27)19-10-12-20(23-24-25-14-6-7-15-25)18(16-19)11-13-21(26)17-8-4-3-5-9-17/h3-5,8-13,16,21,26H,2,6-7,14-15H2,1H3/b13-11+,24-23+
InChIKey AFMIWTSHFGKSAX-YTQZXPMWSA-N
Literature Reference DOI 10.1002/anie.201306632
Molecular Weight 379.460 g/mol
SMILES OC(\C=C\c1cc(C(=O)OCC)ccc1\N=N\N1CCCC1)c1ccccc1
SPLASH splash10-05ic-0891000000-317494b08cbb9fa0c339
Source of Spectrum ACI-52-SM-1a
Synonyms Ethyl 3-((E)-3-hydroxy-3-phenylprop-1-en-1-yl)-4-((E)-pyrrolidin-1-yldiazenyl)benzoate
Wiley ID 1781918