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2-(3,5-Dimethoxy-4-hydroxyphenyl)-1,3-dinitropropane
SpectraBase Compound ID JirJHw31ulD
InChI InChI=1S/C11H14N2O7/c1-19-9-3-7(4-10(20-2)11(9)14)8(5-12(15)16)6-13(17)18/h3-4,8,14H,5-6H2,1-2H3
InChIKey QIWQUQZVIPLNSC-UHFFFAOYSA-N
Mol Weight 286.24 g/mol
Molecular Formula C11H14N2O7
Exact Mass 286.080101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYHCV79QjqK
Name 2-(3,5-Dimethoxy-4-hydroxyphenyl)-1,3-dinitropropane
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 286.080100792 u
Formula C11H14N2O7
InChI InChI=1S/C11H14N2O7/c1-19-9-3-7(4-10(20-2)11(9)14)8(5-12(15)16)6-13(17)18/h3-4,8,14H,5-6H2,1-2H3
InChIKey QIWQUQZVIPLNSC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 286.240 g/mol
Nominal Mass 286 u
Quality 987
Retention Index 2233
SMILES OC=1C(=CC(C(C[N+](=O)[O-])C[N+](=O)[O-])=CC1OC)OC
SPLASH splash10-004r-9810000000-c32d14c4d356b3216ad1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(1,3-dinitropropan-2-yl)-2,6-dimethoxyphenol
Technique GC/MS
Wiley ID DD2024_004461