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Methyl 3-[5-(4-methyl-2-{[(4-methylphenyl)sulfonyl]amino}phenyl)-2-furyl]propanoate
SpectraBase Compound ID CeELf8EOJ9s
InChI InChI=1S/C22H23NO5S/c1-15-4-9-18(10-5-15)29(25,26)23-20-14-16(2)6-11-19(20)21-12-7-17(28-21)8-13-22(24)27-3/h4-7,9-12,14,23H,8,13H2,1-3H3
InChIKey CGIVMTRFIHEXJW-UHFFFAOYSA-N
Mol Weight 413.49 g/mol
Molecular Formula C22H23NO5S
Exact Mass 413.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcTfhrBRTwx
Name Methyl 3-[5-(4-methyl-2-{[(4-methylphenyl)sulfonyl]amino}phenyl)-2-furyl]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO5S
InChI InChI=1S/C22H23NO5S/c1-15-4-9-18(10-5-15)29(25,26)23-20-14-16(2)6-11-19(20)21-12-7-17(28-21)8-13-22(24)27-3/h4-7,9-12,14,23H,8,13H2,1-3H3
InChIKey CGIVMTRFIHEXJW-UHFFFAOYSA-N
Molecular Weight 413.488 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)c1c(-c2oc(CCC(=O)OC)cc2)ccc(c1)C
SPLASH splash10-0a4i-3590000000-6c59babcf26cb0b0dd9e
Source of Spectrum F-68-624-7l
Wiley ID 1707461