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Diethyl 2,6'-diazulene-1',3'-dicarboxylate
SpectraBase Compound ID DcSR4kIgvdC
InChI InChI=1S/C26H22O4/c1-3-29-25(27)23-16-24(26(28)30-4-2)22-13-11-17(10-12-21(22)23)20-14-18-8-6-5-7-9-19(18)15-20/h5-16H,3-4H2,1-2H3
InChIKey JFVZWKQXOXVNIE-UHFFFAOYSA-N
Mol Weight 398.46 g/mol
Molecular Formula C26H22O4
Exact Mass 398.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHqD49aDEt4
Name Diethyl 2,6'-diazulene-1',3'-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22O4
InChI InChI=1S/C26H22O4/c1-3-29-25(27)23-16-24(26(28)30-4-2)22-13-11-17(10-12-21(22)23)20-14-18-8-6-5-7-9-19(18)15-20/h5-16H,3-4H2,1-2H3
InChIKey JFVZWKQXOXVNIE-UHFFFAOYSA-N
Molecular Weight 398.458 g/mol
SMILES c12c(c(C(=O)OCC)cc2C(=O)OCC)ccc(-c2cc3cccccc3c2)cc1
SPLASH splash10-0002-0009000000-c2649ac6ad04739ea911
Source of Spectrum K-2002-1904-12
Synonyms 6-(2-azulenyl)azulene-1,3-dicarboxylic acid diethyl ester Diethyl 6-azulen-2-ylazulene-1,3-dicarboxylate
Wiley ID 1612975