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1-[(4-methoxyphenyl)sulfonylcarbamoyl]tetralin-1-carboxylic acid ethyl ester
SpectraBase Compound ID E3guLYeJdJg
InChI InChI=1S/C21H23NO6S/c1-3-28-20(24)21(14-6-8-15-7-4-5-9-18(15)21)19(23)22-29(25,26)17-12-10-16(27-2)11-13-17/h4-5,7,9-13H,3,6,8,14H2,1-2H3,(H,22,23)
InChIKey VXDXEERBGVXXBP-UHFFFAOYSA-N
Mol Weight 417.48 g/mol
Molecular Formula C21H23NO6S
Exact Mass 417.124609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PRPUwUwpE
Name 1-[(4-methoxyphenyl)sulfonylcarbamoyl]tetralin-1-carboxylic acid ethyl ester
Alternate Name(s) 1-[[(4-methoxyphenyl)sulfonylamino]-oxomethyl]-3,4-dihydro-2H-naphthalene-1-carboxylic acid ethyl ester Ethyl 1-[(4-methoxyphenyl)sulfonylcarbamoyl]-3,4-dihydro-2H-naphthalene-1-carboxylate Ethyl 1-[(4-methoxyphenyl)sulfonylcarbamoyl]tetralin-1-carboxylate
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Formula C21H23NO6S
InChI InChI=1S/C21H23NO6S/c1-3-28-20(24)21(14-6-8-15-7-4-5-9-18(15)21)19(23)22-29(25,26)17-12-10-16(27-2)11-13-17/h4-5,7,9-13H,3,6,8,14H2,1-2H3,(H,22,23)
InChIKey VXDXEERBGVXXBP-UHFFFAOYSA-N
Molecular Weight 417.476 g/mol
SMILES N(C(C1(c2c(cccc2)CCC1)C(=O)OCC)=O)S(c1ccc(cc1)OC)(=O)=O
SPLASH splash10-0ufr-0790000000-6524763ded17e800bef4
Source of Spectrum J-64-5136-3
Wiley ID 1530716