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3,5-bis(Benzylsulfanyl)-1,7-dipropyl-3H-pyrrolo[3,2-f]indole-2,6-dione
SpectraBase Compound ID EfcLFAbOwq7
InChI InChI=1S/C30H32N2O2S2/c1-3-15-31-25-18-26-24(17-23(25)27(29(31)33)35-19-21-11-7-5-8-12-21)28(30(34)32(26)16-4-2)36-20-22-13-9-6-10-14-22/h5-14,17-18,27-28H,3-4,15-16,19-20H2,1-2H3
InChIKey GVHXUOJULIZMEI-UHFFFAOYSA-N
Mol Weight 516.7 g/mol
Molecular Formula C30H32N2O2S2
Exact Mass 516.190521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7eGqXRJD8qT
Name 3,5-bis(Benzylsulfanyl)-1,7-dipropyl-3H-pyrrolo[3,2-f]indole-2,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H32N2O2S2
InChI InChI=1S/C30H32N2O2S2/c1-3-15-31-25-18-26-24(17-23(25)27(29(31)33)35-19-21-11-7-5-8-12-21)28(30(34)32(26)16-4-2)36-20-22-13-9-6-10-14-22/h5-14,17-18,27-28H,3-4,15-16,19-20H2,1-2H3
InChIKey GVHXUOJULIZMEI-UHFFFAOYSA-N
Molecular Weight 516.718 g/mol
SMILES c12N(C(=O)C(c2cc2c(c1)N(C(=O)C2SCc1ccccc1)CCC)SCc1ccccc1)CCC
SPLASH splash10-0006-9000000000-3c1733e4811955a7fe95
Source of Spectrum F5-7-595-42
Wiley ID 1696398