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8,9,10-trimethoxy-2-tosyl-2,3,4,6-tetrahydro-1H-benzo[5,6]oxepino[3,4-e]isoindole
SpectraBase Compound ID DFA2bHK2Mtw
InChI InChI=1S/C26H27NO6S/c1-16-5-8-19(9-6-16)34(28,29)27-12-17-7-10-20-22(21(17)13-27)15-33-14-18-11-23(30-2)25(31-3)26(32-4)24(18)20/h5-11H,12-15H2,1-4H3
InChIKey WKGMWHGIGPYMCG-UHFFFAOYSA-N
Mol Weight 481.56 g/mol
Molecular Formula C26H27NO6S
Exact Mass 481.155909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CnG6sVste1
Name 8,9,10-trimethoxy-2-tosyl-2,3,4,6-tetrahydro-1H-benzo[5,6]oxepino[3,4-e]isoindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO6S
InChI InChI=1S/C26H27NO6S/c1-16-5-8-19(9-6-16)34(28,29)27-12-17-7-10-20-22(21(17)13-27)15-33-14-18-11-23(30-2)25(31-3)26(32-4)24(18)20/h5-11H,12-15H2,1-4H3
InChIKey WKGMWHGIGPYMCG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol802542c
Molecular Weight 481.563 g/mol
SMILES c1c(OC)c(c(c-2c1COCc1c2ccc2c1CN(C2)S(c1ccc(cc1)C)(=O)=O)OC)OC
SPLASH splash10-0006-9022100000-1189317bd6748bcd31f2
Source of Spectrum A1-11-341/SMS124-36
Wiley ID 1756458