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1-(2,5-Dimethoxyphenyl)-2-nitrobut-1-ene
SpectraBase Compound ID Dx0PRv2GnyC
InChI InChI=1S/C12H15NO4/c1-4-10(13(14)15)7-9-8-11(16-2)5-6-12(9)17-3/h5-8H,4H2,1-3H3/b10-7+
InChIKey IJEJVSFRSPCLJI-JXMROGBWSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2m4y4pMZ6X2
Name 1-(2,5-Dimethoxyphenyl)-2-nitrobut-1-ene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 237.100107963 u
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-4-10(13(14)15)7-9-8-11(16-2)5-6-12(9)17-3/h5-8H,4H2,1-3H3/b10-7+
InChIKey IJEJVSFRSPCLJI-JXMROGBWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 237.255 g/mol
Nominal Mass 237 u
Quality 995
Retention Index 1768
SMILES C=1(C(=CC=C(C1)OC)OC)\C=C/([N+](=O)[O-])CC
SPLASH splash10-000i-3930000000-11b95c6d5cd7d7651c57
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,4-dimethoxy-2-((1E)-2-nitrobut-1-en-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_001093