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Diethyl 6-tolylazulene-1,3-dicarboxylate
SpectraBase Compound ID 8R6OmlqAF5h
InChI InChI=1S/C23H22O4/c1-4-26-22(24)20-14-21(23(25)27-5-2)19-13-11-17(10-12-18(19)20)16-8-6-15(3)7-9-16/h6-14H,4-5H2,1-3H3
InChIKey VXYQDPZOANEDEO-UHFFFAOYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C23H22O4
Exact Mass 362.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aa22Y3nrO4e
Name Diethyl 6-tolylazulene-1,3-dicarboxylate
Alternate Name(s) Diethyl 6-(4-methylphenyl)-1,3-azulenedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O4
InChI InChI=1S/C23H22O4/c1-4-26-22(24)20-14-21(23(25)27-5-2)19-13-11-17(10-12-18(19)20)16-8-6-15(3)7-9-16/h6-14H,4-5H2,1-3H3
InChIKey VXYQDPZOANEDEO-UHFFFAOYSA-N
Molecular Weight 362.425 g/mol
SMILES c12c(c(C(=O)OCC)cc2C(=O)OCC)ccc(cc1)-c1ccc(cc1)C
SPLASH splash10-03di-0019000000-3a640a506154d3805bdc
Source of Spectrum K-2002-1902-5
Wiley ID 1612987