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1-(2,5-Dimethoxy-4-methyl-phenyl)-2-nitroprop-1-ene
SpectraBase Compound ID GToJPBZZvuF
InChI InChI=1S/C12H15NO4/c1-8-5-12(17-4)10(7-11(8)16-3)6-9(2)13(14)15/h5-7H,1-4H3/b9-6-
InChIKey UCHNBPYWHXIUPN-TWGQIWQCSA-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 Dmaxj3pAbg0
Name 1-(2,5-Dimethoxy-4-methyl-phenyl)-2-nitroprop-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/c1-8-5-12(17-4)10(7-11(8)16-3)6-9(2)13(14)15/h5-7H,1-4H3/b9-6-
InChIKey UCHNBPYWHXIUPN-TWGQIWQCSA-N
Ionization Type Chemical Ionization (CI)
Molecular Weight 237.255 g/mol
Nominal Mass 237 u
Reagent Gas Methane
Retention Index 1768
SMILES C1(=C(C=C(C(=C1)OC)C)OC)\C=C\([N+](=O)[O-])C
SPLASH splash10-001r-0960000000-797f9f6f2e8f76ebc5fd
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2,5-Dimethoxy-4-methyl-phenyl)-2-nitropropene 1,4-dimethoxy-2-methyl-5-((1Z)-2-nitroprop-1-en-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_001058