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(+-)-3-Benzyl-3-methoxycarbonyl-2-(4-methoxyphenyl)methyl-1,2-benzisothiazoline 1,1-dioxide
SpectraBase Compound ID 3wOMiaewvss
InChI InChI=1S/C24H23NO5S/c1-29-20-14-12-19(13-15-20)17-25-24(23(26)30-2,16-18-8-4-3-5-9-18)21-10-6-7-11-22(21)31(25,27)28/h3-15H,16-17H2,1-2H3
InChIKey XYSVDBGCJMKTRK-UHFFFAOYSA-N
Mol Weight 437.51 g/mol
Molecular Formula C24H23NO5S
Exact Mass 437.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hpw5bYYwMih
Name (+-)-3-Benzyl-3-methoxycarbonyl-2-(4-methoxyphenyl)methyl-1,2-benzisothiazoline 1,1-dioxide
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Formula C24H23NO5S
InChI InChI=1S/C24H23NO5S/c1-29-20-14-12-19(13-15-20)17-25-24(23(26)30-2,16-18-8-4-3-5-9-18)21-10-6-7-11-22(21)31(25,27)28/h3-15H,16-17H2,1-2H3
InChIKey XYSVDBGCJMKTRK-UHFFFAOYSA-N
Molecular Weight 437.510 g/mol
SMILES C1(N(S(c2c1cccc2)(=O)=O)Cc1ccc(cc1)OC)(C(=O)OC)Cc1ccccc1
SPLASH splash10-01w1-9200100000-ccab3e73bf1105243df3
Source of Spectrum J-65-7695-25
Synonyms 2-[(4-methoxyphenyl)methyl]-1,1-dioxo-3-(phenylmethyl)-1,2-benzothiazole-3-carboxylic acid methyl ester Methyl 3-benzyl-2-[(4-methoxyphenyl)methyl]-1,1-dioxo-1,2-benzothiazole-3-carboxylate Methyl 2-[(4-methoxyphenyl)methyl]-1,1-bis(oxidanylidene)-3-(phenylmethyl)-1,2-benzothiazole-3-carboxylate
Wiley ID 1533695