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Diethyl-2-methyl-phenanthrene-1,3-dicarboxylate
SpectraBase Compound ID 5e5F3xU9Mpf
InChI InChI=1S/C21H20O4/c1-4-24-20(22)17-12-15-11-10-14-8-6-7-9-16(14)19(15)18(13(17)3)21(23)25-5-2/h6-12H,4-5H2,1-3H3
InChIKey BESVKUIBLMINJQ-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C21H20O4
Exact Mass 336.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FagKePKtL22
Name Diethyl-2-methyl-phenanthrene-1,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O4
InChI InChI=1S/C21H20O4/c1-4-24-20(22)17-12-15-11-10-14-8-6-7-9-16(14)19(15)18(13(17)3)21(23)25-5-2/h6-12H,4-5H2,1-3H3
InChIKey BESVKUIBLMINJQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200347g
Molecular Weight 336.387 g/mol
SMILES C(c1c(C)c(C(=O)OCC)c2c(ccc3c2cccc3)c1)(OCC)=O
SPLASH splash10-000i-0297000000-356da83b84d62209d516
Source of Spectrum A1-13-1972/SMS49-11
Synonyms Diethyl 3-methylphenanthrene-2,4-dicarboxylate
Wiley ID 1753012