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Diethyl 6,6'-diazulene-1,3-dicarboxylate
SpectraBase Compound ID DSHMN1o32Ws
InChI InChI=1S/C26H22O4/c1-3-29-25(27)23-16-24(26(28)30-4-2)22-15-13-20(12-14-21(22)23)19-10-8-17-6-5-7-18(17)9-11-19/h5-16H,3-4H2,1-2H3
InChIKey HQVSKPSMWHDECF-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 IljMa4NInOk
Name Diethyl 6,6'-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)22-15-13-20(12-14-21(22)23)19-10-8-17-6-5-7-18(17)9-11-19/h5-16H,3-4H2,1-2H3
InChIKey HQVSKPSMWHDECF-UHFFFAOYSA-N
Molecular Weight 398.458 g/mol
SMILES c12c(c(C(=O)OCC)cc2C(=O)OCC)ccc(cc1)-c1ccc2cccc2cc1
SPLASH splash10-0002-0009000000-65623c8eba8d0543d38e
Source of Spectrum K-2002-1903-11
Wiley ID 1612976