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N-(1-[4-Ethyl-2-methoxy-5-methylthiophenyl]propan-2-yl)-3-methoxybenzamide
SpectraBase Compound ID 737IUm7kPl8
InChI InChI=1S/C21H27NO3S/c1-6-15-12-19(25-4)17(13-20(15)26-5)10-14(2)22-21(23)16-8-7-9-18(11-16)24-3/h7-9,11-14H,6,10H2,1-5H3,(H,22,23)
InChIKey NPTGRKNOHCYWJK-UHFFFAOYSA-N
Mol Weight 373.51 g/mol
Molecular Formula C21H27NO3S
Exact Mass 373.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dnmch5iXK7c
Name N-(1-[4-Ethyl-2-methoxy-5-methylthiophenyl]propan-2-yl)-3-methoxybenzamide
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 373.171164904 u
Formula C21H27NO3S
InChI InChI=1S/C21H27NO3S/c1-6-15-12-19(25-4)17(13-20(15)26-5)10-14(2)22-21(23)16-8-7-9-18(11-16)24-3/h7-9,11-14H,6,10H2,1-5H3,(H,22,23)
InChIKey NPTGRKNOHCYWJK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 373.511 g/mol
Nominal Mass 373 u
Quality 999
Retention Index 2939
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CC(NC(C=1C=C(C=CC1)OC)=O)C
SPLASH splash10-00dr-1941000000-448da205294c42e6f085
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(4-ethyl-2-methoxy-5-methylthiophenyl)propan-2-yl)-3-methoxybenzamide
Technique GC/MS
Wiley ID DD2024_022606