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7-(4'-Nitrobenzyloxy)-4-methyl-2-thiocoumarin
SpectraBase Compound ID D1ZWot8Sa6w
InChI InChI=1S/C17H13NO4S/c1-11-8-17(23)22-16-9-14(6-7-15(11)16)21-10-12-2-4-13(5-3-12)18(19)20/h2-9H,10H2,1H3
InChIKey BYEGICRGMUVCCN-UHFFFAOYSA-N
Mol Weight 327.35 g/mol
Molecular Formula C17H13NO4S
Exact Mass 327.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTa39bCFPgW
Name 7-(4'-Nitrobenzyloxy)-4-methyl-2-thiocoumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO4S
InChI InChI=1S/C17H13NO4S/c1-11-8-17(23)22-16-9-14(6-7-15(11)16)21-10-12-2-4-13(5-3-12)18(19)20/h2-9H,10H2,1H3
InChIKey BYEGICRGMUVCCN-UHFFFAOYSA-N
Molecular Weight 327.354 g/mol
SMILES c1(N(=O)=O)ccc(cc1)COc1cc2OC(=S)C=C(c2cc1)C
SPLASH splash10-002b-0904000000-360d7809ae29469d35e9
Source of Spectrum AJ-42-742-21
Synonyms 4-Methyl-7-[(4-nitrobenzyl)oxy]-2H-chromene-2-thione 4-Methyl-7-[(4-nitrophenyl)methoxy]-1-benzopyran-2-thione 4-Methyl-7-[(4-nitrophenyl)methoxy]chromene-2-thione
Wiley ID 1567963