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N-[3-(4-Methyl-5-oxo-2,5-dihydrofuran-2-yloxymethylene)-2-oxo-3,3a,4,8b-tetrahydro-2H-indeno[1,2-b]furan-7-yl]-5-dimethylaminonaphthalene-1-sulfonamide diastereoisomer

View entire compound with spectra: 1 MS (GC)

N-[3-(4-Methyl-5-oxo-2,5-dihydrofuran-2-yloxymethylene)-2-oxo-3,3a,4,8b-tetrahydro-2H-indeno[1,2-b]furan-7-yl]-5-dimethylaminonaphthalene-1-sulfonamide diastereoisomer
SpectraBase Compound ID FO8mrf7FOst
InChI InChI=1S/C29H26N2O7S/c1-16-12-26(37-28(16)32)36-15-23-22-13-17-10-11-18(14-21(17)27(22)38-29(23)33)30-39(34,35)25-9-5-6-19-20(25)7-4-8-24(19)31(2)3/h4-12,14-15,22,26-27,30H,13H2,1-3H3/b23-15-
InChIKey XNCZXTICPVAOBY-HAHDFKILSA-N
Mol Weight 546.59 g/mol
Molecular Formula C29H26N2O7S
Exact Mass 546.146072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSXxeVb4EwV
Name N-[3-(4-Methyl-5-oxo-2,5-dihydrofuran-2-yloxymethylene)-2-oxo-3,3a,4,8b-tetrahydro-2H-indeno[1,2-b]furan-7-yl]-5-dimethylaminonaphthalene-1-sulfonamide diastereoisomer
Alternate Name(s) 5-(dimethylamino)-N-((3Z)-3-{[(4-methyl-5-oxo-2,5-dihydro-2-furanyl)oxy]methylene}-2-oxo-3,3a,4,8b-tetrahydro-2H-indeno[1,2-b]furan-7-yl)-1-naphthalenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H26N2O7S
InChI InChI=1S/C29H26N2O7S/c1-16-12-26(37-28(16)32)36-15-23-22-13-17-10-11-18(14-21(17)27(22)38-29(23)33)30-39(34,35)25-9-5-6-19-20(25)7-4-8-24(19)31(2)3/h4-12,14-15,22,26-27,30H,13H2,1-3H3/b23-15-
InChIKey XNCZXTICPVAOBY-HAHDFKILSA-N
Molecular Weight 546.594 g/mol
SMILES N(S(c1c2c(c(N(C)C)ccc2)ccc1)(=O)=O)c1cc2C3C(\C(=C\OC4OC(=O)C(=C4)C)C(O3)=O)Cc2cc1
SPLASH splash10-004i-9000000000-f202934d23e035207dd3
Source of Spectrum KC-0-764-10
Wiley ID 787588