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1H-Indole-3-ethanol, 5-[(4-nitrobenzoyl)oxy]-, 4-nitrobenzoate(ester)
SpectraBase Compound ID B0leR6CHMyY
InChI InChI=1S/C24H17N3O8/c28-23(15-1-5-18(6-2-15)26(30)31)34-12-11-17-14-25-22-10-9-20(13-21(17)22)35-24(29)16-3-7-19(8-4-16)27(32)33/h1-10,13-14,25H,11-12H2
InChIKey BZKJMWLVPLGMIR-UHFFFAOYSA-N
Mol Weight 475.41 g/mol
Molecular Formula C24H17N3O8
Exact Mass 475.101565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0eu4xJNrgR
Name 1H-Indole-3-ethanol, 5-[(4-nitrobenzoyl)oxy]-, 4-nitrobenzoate(ester)
CAS Registry Number 130164-62-4
Comments Less than 3 mono-isotopic peaks
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Formula C24H17N3O8
InChI InChI=1S/C24H17N3O8/c28-23(15-1-5-18(6-2-15)26(30)31)34-12-11-17-14-25-22-10-9-20(13-21(17)22)35-24(29)16-3-7-19(8-4-16)27(32)33/h1-10,13-14,25H,11-12H2
InChIKey BZKJMWLVPLGMIR-UHFFFAOYSA-N
Molecular Weight 475.413 g/mol
SMILES [nH]1c2c(c(c1)CCOC(c1ccc(N(=O)=O)cc1)=O)cc(cc2)OC(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-004i-0008900000-a52138a09bc1e71d6836
Source of Spectrum F-46-4693-4
Synonyms 3-(2-(p-nitrobenzoyl-ethyl)-5-(p-nitrobenzoyl)-indole 3-{2-[(4-nitrobenzoyl)oxy]ethyl}-1H-indol-5-yl 4-nitrobenzoate
Wiley ID 1394091