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2,2-Bis(5'-bromo-1'-methyl-3'-indolyl)nitroethane
SpectraBase Compound ID 4bdfUbPqdsG
InChI InChI=1S/C20H17Br2N3O2/c1-23-9-16(14-7-12(21)3-5-19(14)23)18(11-25(26)27)17-10-24(2)20-6-4-13(22)8-15(17)20/h3-10,18H,11H2,1-2H3
InChIKey UIUMGJNRAWUETH-UHFFFAOYSA-N
Mol Weight 491.18 g/mol
Molecular Formula C20H17Br2N3O2
Exact Mass 488.968753 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOCrNbjneIH
Name 2,2-Bis(5'-bromo-1'-methyl-3'-indolyl)nitroethane
Alternate Name(s) 5-Bromo-3-[1-(5-bromo-1-methyl-1H-indol-3-yl)-2-nitroethyl]-1-methyl-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17Br2N3O2
InChI InChI=1S/C20H17Br2N3O2/c1-23-9-16(14-7-12(21)3-5-19(14)23)18(11-25(26)27)17-10-24(2)20-6-4-13(22)8-15(17)20/h3-10,18H,11H2,1-2H3
InChIKey UIUMGJNRAWUETH-UHFFFAOYSA-N
Molecular Weight 491.183 g/mol
SMILES c1(C(c2c3c(ccc(c3)Br)[n](c2)C)CN(=O)=O)c2c(ccc(c2)Br)[n](c1)C
SPLASH splash10-017l-0910600000-c98a4c70a9e03edf5f07
Source of Spectrum KC-60-1946-8
Wiley ID 1583547