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Ethyl 3-(1-Methylethyl)-4,5-dioxo-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate
SpectraBase Compound ID Lwbs1AAxxEh
InChI InChI=1S/C18H16O4S/c1-4-22-18(21)17-12(9(2)3)13-15(20)14(19)10-7-5-6-8-11(10)16(13)23-17/h5-9H,4H2,1-3H3
InChIKey CZBBLBKXKBTMSA-UHFFFAOYSA-N
Mol Weight 328.38 g/mol
Molecular Formula C18H16O4S
Exact Mass 328.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0sYyf4pgSO
Name Ethyl 3-(1-Methylethyl)-4,5-dioxo-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate
Alternate Name(s) ethyl 3-isopropyl-4,5-dioxo-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C18H16O4S
InChI InChI=1S/C18H16O4S/c1-4-22-18(21)17-12(9(2)3)13-15(20)14(19)10-7-5-6-8-11(10)16(13)23-17/h5-9H,4H2,1-3H3
InChIKey CZBBLBKXKBTMSA-UHFFFAOYSA-N
Molecular Weight 328.382 g/mol
SMILES c-12c(c(c(s2)C(=O)OCC)C(C)C)C(C(c2ccccc12)=O)=O
SPLASH splash10-001i-0093000000-dd333ebeafe4706684f5
Source of Spectrum O1-65-2976-4
Wiley ID 1593399