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3-Msityl-4-[p-(methoxycarbonyl)benzenesulfonyl]-5-methyl-1,2-oxazole
SpectraBase Compound ID 9mEXlcnHvnR
InChI InChI=1S/C21H21NO5S/c1-12-10-13(2)18(14(3)11-12)19-20(15(4)27-22-19)28(24,25)17-8-6-16(7-9-17)21(23)26-5/h6-11H,1-5H3
InChIKey DMGXZCPLRZJETC-UHFFFAOYSA-N
Mol Weight 399.46 g/mol
Molecular Formula C21H21NO5S
Exact Mass 399.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lNbkpmIrnd
Name 3-Msityl-4-[p-(methoxycarbonyl)benzenesulfonyl]-5-methyl-1,2-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO5S
InChI InChI=1S/C21H21NO5S/c1-12-10-13(2)18(14(3)11-12)19-20(15(4)27-22-19)28(24,25)17-8-6-16(7-9-17)21(23)26-5/h6-11H,1-5H3
InChIKey DMGXZCPLRZJETC-UHFFFAOYSA-N
Molecular Weight 399.461 g/mol
SMILES c1(c(noc1C)-c1c(cc(cc1C)C)C)S(c1ccc(C(=O)OC)cc1)(=O)=O
SPLASH splash10-0006-9400000000-701ecde529fb71c4ad45
Source of Spectrum J-73-8066-45
Wiley ID 1668706