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Dimethoxanate
SpectraBase Compound ID Ekm7x4Sci0L
InChI InChI=1S/C19H22N2O3S/c1-20(2)11-12-23-13-14-24-19(22)21-15-7-3-5-9-17(15)25-18-10-6-4-8-16(18)21/h3-10H,11-14H2,1-2H3
InChIKey OOVJCSPCMCAXEX-UHFFFAOYSA-N
Mol Weight 358.46 g/mol
Molecular Formula C19H22N2O3S
Exact Mass 358.135114 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID HL8zGcu33GZ
Name Dimethoxanate
CAS Registry Number 477-93-0
Collision Energy 5 eV
Copyright Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved.
Exact Mass 358.135113747 u
Formula C19H22N2O3S
InChI InChI=1S/C19H22N2O3S/c1-20(2)11-12-23-13-14-24-19(22)21-15-7-3-5-9-17(15)25-18-10-6-4-8-16(18)21/h3-10H,11-14H2,1-2H3
InChIKey OOVJCSPCMCAXEX-UHFFFAOYSA-N
Instrument Name QStar XL, AB Sciex
Ion Polarity P
Ionization Type ESI+
Molecular Weight 358.456 g/mol
Nominal Mass 358 u
Precursor Ion [M+H]+
Precursor m/z 359.142
SMILES C=12SC=3C(N(C2=CC=CC1)C(OCCOCCN(C)C)=O)=CC=CC3
Selected Ion Charge 1
Source of Spectrum Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria
Spectrum Type ms2
Synonyms 2-[2-(dimethylamino)ethoxy]ethyl phenothiazine-10-carboxylate
Technique Q-TOF
Wiley ID MSforID_+_296.9