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Ethyl 4-[1,3-Bis(ethoxycarbonyl)-6-azulenylamino]-2,3-dimethyl-2-butene-1-sulfinate
SpectraBase Compound ID CmG0xwZ2HH3
InChI InChI=1S/C24H31NO6S/c1-6-29-23(26)21-13-22(24(27)30-7-2)20-12-10-18(9-11-19(20)21)25-14-16(4)17(5)15-32(28)31-8-3/h9-13,25H,6-8,14-15H2,1-5H3/b17-16+
InChIKey SOZDJADSQNSREN-WUKNDPDISA-N
Mol Weight 461.57 g/mol
Molecular Formula C24H31NO6S
Exact Mass 461.187209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FCVuME3Hc
Name Ethyl 4-[1,3-Bis(ethoxycarbonyl)-6-azulenylamino]-2,3-dimethyl-2-butene-1-sulfinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO6S
InChI InChI=1S/C24H31NO6S/c1-6-29-23(26)21-13-22(24(27)30-7-2)20-12-10-18(9-11-19(20)21)25-14-16(4)17(5)15-32(28)31-8-3/h9-13,25H,6-8,14-15H2,1-5H3/b17-16+
InChIKey SOZDJADSQNSREN-WUKNDPDISA-N
Molecular Weight 461.573 g/mol
SMILES N(c1ccc2c(c(C(=O)OCC)cc2C(=O)OCC)cc1)C\C(=C\(CS(=O)OCC)C)C
SPLASH splash10-014i-0009100000-5cdddd15a8edbc7ba870
Source of Spectrum F-59-4657-16
Wiley ID 1678160