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2-Ethylhexyl 3-Methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-2-carboxylate
SpectraBase Compound ID 2hM37no9XT7
InChI InChI=1S/C22H24O4S/c1-4-6-9-14(5-2)12-26-22(25)20-13(3)17-18(23)15-10-7-8-11-16(15)19(24)21(17)27-20/h7-8,10-11,14H,4-6,9,12H2,1-3H3
InChIKey UFDQZGUMZADLCF-UHFFFAOYSA-N
Mol Weight 384.49 g/mol
Molecular Formula C22H24O4S
Exact Mass 384.13953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16pFKConREW
Name 2-Ethylhexyl 3-Methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C22H24O4S
InChI InChI=1S/C22H24O4S/c1-4-6-9-14(5-2)12-26-22(25)20-13(3)17-18(23)15-10-7-8-11-16(15)19(24)21(17)27-20/h7-8,10-11,14H,4-6,9,12H2,1-3H3
InChIKey UFDQZGUMZADLCF-UHFFFAOYSA-N
Molecular Weight 384.490 g/mol
SMILES c12c(c(c(s2)C(=O)OCC(CCCC)CC)C)C(c2ccccc2C1=O)=O
SPLASH splash10-00di-0090000000-5a2966308f10e8626583
Source of Spectrum H1-55-2428-7
Wiley ID 1564732