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Dicyclohexyl (phenylsulfonylmethylene)malonate
SpectraBase Compound ID 5ZMJ4qKHehU
InChI InChI=1S/C22H28O6S/c23-21(27-17-10-4-1-5-11-17)20(22(24)28-18-12-6-2-7-13-18)16-29(25,26)19-14-8-3-9-15-19/h3,8-9,14-18H,1-2,4-7,10-13H2
InChIKey KEUWTJFRFUTEAA-UHFFFAOYSA-N
Mol Weight 420.52 g/mol
Molecular Formula C22H28O6S
Exact Mass 420.16066 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZBo1J6rXQr
Name Dicyclohexyl (phenylsulfonylmethylene)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O6S
InChI InChI=1S/C22H28O6S/c23-21(27-17-10-4-1-5-11-17)20(22(24)28-18-12-6-2-7-13-18)16-29(25,26)19-14-8-3-9-15-19/h3,8-9,14-18H,1-2,4-7,10-13H2
InChIKey KEUWTJFRFUTEAA-UHFFFAOYSA-N
Molecular Weight 420.520 g/mol
SMILES C(C(C(=O)OC1CCCCC1)=CS(=O)(=O)c1ccccc1)(=O)OC1CCCCC1
SPLASH splash10-0570-0690000000-14dcedb7e07659b81be7
Source of Spectrum SO-0-534-5
Synonyms dicyclohexyl 2-[(phenylsulfonyl)methylene]malonate
Wiley ID 1544168