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N-[1-(4-Fluoro-2H-1,3-benzodioxol-5-yl)propan-2-yl]-3-methoxybenzamide
SpectraBase Compound ID KqwVUt235ru
InChI InChI=1S/C18H18FNO4/c1-11(20-18(21)13-4-3-5-14(9-13)22-2)8-12-6-7-15-17(16(12)19)24-10-23-15/h3-7,9,11H,8,10H2,1-2H3,(H,20,21)
InChIKey WVEANVYHTFJWJU-UHFFFAOYSA-N
Mol Weight 331.34 g/mol
Molecular Formula C18H18FNO4
Exact Mass 331.121986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHREQXQepMW
Name N-[1-(4-Fluoro-2H-1,3-benzodioxol-5-yl)propan-2-yl]-3-methoxybenzamide
Classification Designer drug precursor
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 331.121986223 u
Formula C18H18FNO4
InChI InChI=1S/C18H18FNO4/c1-11(20-18(21)13-4-3-5-14(9-13)22-2)8-12-6-7-15-17(16(12)19)24-10-23-15/h3-7,9,11H,8,10H2,1-2H3,(H,20,21)
InChIKey WVEANVYHTFJWJU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 331.343 g/mol
Nominal Mass 331 u
Quality 999
Retention Index 2653
SMILES C12=C(C(CC(NC(C=3C=C(C=CC3)OC)=O)C)=CC=C1OCO2)F
SPLASH splash10-0019-1900000000-8eec6617578a9ef59474
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_022618