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Benzene, 2-(2-isothiocyanatopropyl)-1,4-dimethoxy-
SpectraBase Compound ID 59IuI6u1IJS
InChI InChI=1S/C12H15NO2S/c1-9(13-8-16)6-10-7-11(14-2)4-5-12(10)15-3/h4-5,7,9H,6H2,1-3H3
InChIKey QKRWCVGUTUWPOC-UHFFFAOYSA-N
Mol Weight 237.32 g/mol
Molecular Formula C12H15NO2S
Exact Mass 237.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmucwAhQCNU
Name 2,5-Dimethoxyamphetamine CS2
Classification Amphetamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 237.082349899 u
Formula C12H15NO2S
InChI InChI=1S/C12H15NO2S/c1-9(13-8-16)6-10-7-11(14-2)4-5-12(10)15-3/h4-5,7,9H,6H2,1-3H3
InChIKey QKRWCVGUTUWPOC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 237.317 g/mol
Nominal Mass 237 u
Quality 1000
Retention Index 1895
SMILES C=1(C(=CC=C(C1)OC)OC)CC(N=C=S)C
SPLASH splash10-0uki-9820000000-68fc66c326c33e8a9473
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,5-Dimethoxyamphetamine isothiocyanate 1-(2,5-Dimethoxyphenyl)-2-isocyanatopropane
Technique GC/MS
Wiley ID DD2024_018954