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3,5-Dimethoxy-4-hydroxybenzonitrile
SpectraBase Compound ID CN19IpkaHLL
InChI InChI=1S/C9H9NO3/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-4,11H,1-2H3
InChIKey JKPLQGXXESDJLY-UHFFFAOYSA-N
Mol Weight 179.17 g/mol
Molecular Formula C9H9NO3
Exact Mass 179.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHK7ZintQtk
Name 3,5-Dimethoxy-4-hydroxybenzonitrile
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 179.058243151 u
Formula C9H9NO3
InChI InChI=1S/C9H9NO3/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-4,11H,1-2H3
InChIKey JKPLQGXXESDJLY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 179.175 g/mol
Nominal Mass 179 u
Quality 992
Retention Index 1636
SMILES OC1=C(C=C(C=C1OC)C#N)OC
SPLASH splash10-01tc-9600000000-a0304259abcee3d86c4d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-hydroxy-3,5-dimethoxybenzonitrile
Technique GC/MS
Wiley ID DD2024_004474