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1-keto-8-methylsulfinyl-tetralin-5-carboxylic acid ethyl ester
SpectraBase Compound ID CiPaoW9ek4R
InChI InChI=1S/C14H16O4S/c1-3-18-14(16)10-7-8-12(19(2)17)13-9(10)5-4-6-11(13)15/h7-8H,3-6H2,1-2H3
InChIKey FTFZYVPLSHTKEO-UHFFFAOYSA-N
Mol Weight 280.34 g/mol
Molecular Formula C14H16O4S
Exact Mass 280.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AypGC7BaIA
Name 1-keto-8-methylsulfinyl-tetralin-5-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4S
InChI InChI=1S/C14H16O4S/c1-3-18-14(16)10-7-8-12(19(2)17)13-9(10)5-4-6-11(13)15/h7-8H,3-6H2,1-2H3
InChIKey FTFZYVPLSHTKEO-UHFFFAOYSA-N
Molecular Weight 280.338 g/mol
SMILES c12c(c(C(=O)OCC)ccc2S(=O)C)CCCC1=O
SPLASH splash10-014i-0090000000-c0ee70b66a86fe4fce44
Source of Spectrum SK-28-3499-1
Synonyms 4-Methylsulfinyl-5-oxo-7,8-dihydro-6H-naphthalene-1-carboxylic acid ethyl ester Ethyl 4-methylsulfinyl-5-oxidanylidene-7,8-dihydro-6H-naphthalene-1-carboxylate Ethyl 4-methylsulfinyl-5-oxo-7,8-dihydro-6H-naphthalene-1-carboxylate Ethyl 8-methylsulfinyl-1-oxo-tetralin-5-carboxylate
Wiley ID 880154