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Riluzole AC
SpectraBase Compound ID 13deYRhGjWn
InChI InChI=1S/C10H7F3N2O2S/c1-5(16)14-9-15-7-3-2-6(4-8(7)18-9)17-10(11,12)13/h2-4H,1H3,(H,14,15,16)
InChIKey QYNWWANNFXDUBS-UHFFFAOYSA-N
Mol Weight 276.23 g/mol
Molecular Formula C10H7F3N2O2S
Exact Mass 276.018033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FFUc5ITZrW
Name Riluzole AC
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 276.018033134 u
Formula C10H7F3N2O2S
InChI InChI=1S/C10H7F3N2O2S/c1-5(16)14-9-15-7-3-2-6(4-8(7)18-9)17-10(11,12)13/h2-4H,1H3,(H,14,15,16)
InChIKey QYNWWANNFXDUBS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 276.233 g/mol
Nominal Mass 276 u
Quality 912
Retention Index 2122
SMILES C=12C(N=C(S2)NC(=O)C)=CC=C(C1)OC(F)(F)F
SPLASH splash10-00lr-5970000000-3cbb9531a87f35dce299
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(6-(trifluoromethoxy)-1,3-benzothiazol-2-yl)acetamide
Technique GC/MS
Wiley ID DD2024_007778