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N-[(4-chlorophenyl)-(2-keto-4-methoxy-cyclooctyl)methyl]-4-methyl-benzenesulfonamide
SpectraBase Compound ID 4fRsvwQEiTF
InChI InChI=1S/C23H28ClNO4S/c1-16-7-13-20(14-8-16)30(27,28)25-23(17-9-11-18(24)12-10-17)21-6-4-3-5-19(29-2)15-22(21)26/h7-14,19,21,23,25H,3-6,15H2,1-2H3
InChIKey YPQTXVJFFJKHCR-UHFFFAOYSA-N
Mol Weight 449.99 g/mol
Molecular Formula C23H28ClNO4S
Exact Mass 449.142757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgVbg1xdcL0
Name N-[(4-chlorophenyl)-(2-keto-4-methoxy-cyclooctyl)methyl]-4-methyl-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28ClNO4S
InChI InChI=1S/C23H28ClNO4S/c1-16-7-13-20(14-8-16)30(27,28)25-23(17-9-11-18(24)12-10-17)21-6-4-3-5-19(29-2)15-22(21)26/h7-14,19,21,23,25H,3-6,15H2,1-2H3
InChIKey YPQTXVJFFJKHCR-UHFFFAOYSA-N
Molecular Weight 449.993 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C1C(CC(OC)CCCC1)=O)c1ccc(cc1)Cl
SPLASH splash10-0006-9030000000-3010a54cceaa122cf5d8
Source of Spectrum U1-2002-3678-10
Synonyms N-[(4-chlorophenyl)-(4-methoxy-2-oxidanylidene-cyclooctyl)methyl]-4-methyl-benzenesulfonamide N-[(4-chlorophenyl)-(4-methoxy-2-oxo-cyclooctyl)methyl]-4-methyl-benzenesulfonamide
Wiley ID 1523383