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1-(3,5-Dimethoxy-4-(phenethoxy)phenyl)-2-nitrobutene
SpectraBase Compound ID 38k7CyEQ68P
InChI InChI=1S/C20H23NO5/c1-4-17(21(22)23)12-16-13-18(24-2)20(19(14-16)25-3)26-11-10-15-8-6-5-7-9-15/h5-9,12-14H,4,10-11H2,1-3H3/b17-12-
InChIKey LMIXBPPNFDDUOM-ATVHPVEESA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NYQAejWE6V
Name 1-(3,5-Dimethoxy-4-(phenethoxy)phenyl)-2-nitrobutene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 357.157622840 u
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-4-17(21(22)23)12-16-13-18(24-2)20(19(14-16)25-3)26-11-10-15-8-6-5-7-9-15/h5-9,12-14H,4,10-11H2,1-3H3/b17-12-
InChIKey LMIXBPPNFDDUOM-ATVHPVEESA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.406 g/mol
Nominal Mass 357 u
Quality 885
Retention Index 2790
SMILES C1(=C(C=C(C=C1OC)\C=C\([N+](=O)[O-])CC)OC)OCCC=1C=CC=CC1
SPLASH splash10-0a4i-3910000000-6e8ac88c1a5be823e20a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,3-dimethoxy-5-((1Z)-2-nitrobut-1-en-1-yl)-2-(2-phenylethoxy)benzene
Technique GC/MS
Wiley ID DD2024_005169