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Diethyl 13-(2-thienyl)-9,10-dihydro-9,10-propanoanthracene-11,11-dicarboxylate
SpectraBase Compound ID DvIE1ezhLyG
InChI InChI=1S/C27H26O4S/c1-3-30-25(28)27(26(29)31-4-2)16-21(22-14-9-15-32-22)23-17-10-5-7-12-19(17)24(27)20-13-8-6-11-18(20)23/h5-15,21,23-24H,3-4,16H2,1-2H3
InChIKey SVHWPKWURGSYFW-UHFFFAOYSA-N
Mol Weight 446.56 g/mol
Molecular Formula C27H26O4S
Exact Mass 446.15518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsXUCUtzKCS
Name Diethyl 13-(2-thienyl)-9,10-dihydro-9,10-propanoanthracene-11,11-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26O4S
InChI InChI=1S/C27H26O4S/c1-3-30-25(28)27(26(29)31-4-2)16-21(22-14-9-15-32-22)23-17-10-5-7-12-19(17)24(27)20-13-8-6-11-18(20)23/h5-15,21,23-24H,3-4,16H2,1-2H3
InChIKey SVHWPKWURGSYFW-UHFFFAOYSA-N
Molecular Weight 446.561 g/mol
SMILES C1(C2c3c(cccc3)C(C(C1)c1sccc1)c1c2cccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-004i-0900000000-43a5f418d4f9dff4a7fb
Source of Spectrum U1-2008-5333-3d
Wiley ID 1710590