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2,4,6-Trimethoxy-B-methyl-B-nitro-styrene
SpectraBase Compound ID HHWUwDyIao6
InChI InChI=1S/C12H15NO5/c1-8(13(14)15)5-10-11(17-3)6-9(16-2)7-12(10)18-4/h5-7H,1-4H3/b8-5+
InChIKey JAPSFFLFSUERST-VMPITWQZSA-N
Mol Weight 253.25 g/mol
Molecular Formula C12H15NO5
Exact Mass 253.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DklEHUz3SxE
Name (E)-2,4,6-Trimethoxyphenyl-2-nitroprop-1-ene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 253.095022582 u
Formula C12H15NO5
InChI InChI=1S/C12H15NO5/c1-8(13(14)15)5-10-11(17-3)6-9(16-2)7-12(10)18-4/h5-7H,1-4H3/b8-5+
InChIKey JAPSFFLFSUERST-VMPITWQZSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 253.254 g/mol
Nominal Mass 253 u
Quality 992
Retention Index 1809
SMILES C1(=C(C=C(C=C1OC)OC)OC)\C=C/([N+](=O)[O-])C
SPLASH splash10-0fh9-3920000000-d79e230c322e54598592
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,3,5-trimethoxy-2-((1E)-2-nitroprop-1-en-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_007562