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2,3,5-trimethyl-6-(2-nitrophenyl)-1-benzothiophene
SpectraBase Compound ID ELNQzNwJAJu
InChI InChI=1S/C17H15NO2S/c1-10-8-15-11(2)12(3)21-17(15)9-14(10)13-6-4-5-7-16(13)18(19)20/h4-9H,1-3H3
InChIKey ZXMZACSIQODRAK-UHFFFAOYSA-N
Mol Weight 297.37 g/mol
Molecular Formula C17H15NO2S
Exact Mass 297.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cj2oHNA6A2S
Name 2,3,5-trimethyl-6-(2-nitrophenyl)-1-benzothiophene
Alternate Name(s) 2,3,5-trimethyl-6-(2-nitrophenyl)benzothiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NO2S
InChI InChI=1S/C17H15NO2S/c1-10-8-15-11(2)12(3)21-17(15)9-14(10)13-6-4-5-7-16(13)18(19)20/h4-9H,1-3H3
InChIKey ZXMZACSIQODRAK-UHFFFAOYSA-N
Molecular Weight 297.372 g/mol
SMILES c1(N(=O)=O)c(-c2cc3sc(C)c(c3cc2C)C)cccc1
SPLASH splash10-0f72-0090000000-fd8135b68d5db3917ec7
Source of Spectrum Y-38-752-3
Wiley ID 848481