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2-[N-Formyl-N-(2-(N,N-diethylamido)phenyl)amino]-1-tosyl-8-[3,4-(methylenedioxy)phenyl]octene
SpectraBase Compound ID 7XBhn8wuWo3
InChI InChI=1S/C34H40N2O6S/c1-4-35(5-2)34(38)30-14-10-11-15-31(30)36(24-37)28(23-43(39,40)29-19-16-26(3)17-20-29)13-9-7-6-8-12-27-18-21-32-33(22-27)42-25-41-32/h10-11,14-24H,4-9,12-13,25H2,1-3H3
InChIKey QIBLXSUTZZYHAS-UHFFFAOYSA-N
Mol Weight 604.8 g/mol
Molecular Formula C34H40N2O6S
Exact Mass 604.260708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9cGJF18bA
Name 2-[N-Formyl-N-(2-(N,N-diethylamido)phenyl)amino]-1-tosyl-8-[3,4-(methylenedioxy)phenyl]octene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H40N2O6S
InChI InChI=1S/C34H40N2O6S/c1-4-35(5-2)34(38)30-14-10-11-15-31(30)36(24-37)28(23-43(39,40)29-19-16-26(3)17-20-29)13-9-7-6-8-12-27-18-21-32-33(22-27)42-25-41-32/h10-11,14-24H,4-9,12-13,25H2,1-3H3
InChIKey QIBLXSUTZZYHAS-UHFFFAOYSA-N
Molecular Weight 604.762 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)=C(N(c1c(C(N(CC)CC)=O)cccc1)C=O)CCCCCCc1cc2OCOc2cc1
SPLASH splash10-008a-0905400000-8c8c67f3616c6c57dbf2
Source of Spectrum F-68-2229-25
Wiley ID 1572002