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N-Tosyl-5-nitroindole
SpectraBase Compound ID BLBcii39zzM
InChI InChI=1S/C15H12N2O4S/c1-11-2-5-14(6-3-11)22(20,21)16-9-8-12-10-13(17(18)19)4-7-15(12)16/h2-10H,1H3
InChIKey LNSITYAYVOYMGC-UHFFFAOYSA-N
Mol Weight 316.33 g/mol
Molecular Formula C15H12N2O4S
Exact Mass 316.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMc1K6xxpxd
Name N-Tosyl-5-nitroindole
Alternate Name(s) 1-(4-methylphenyl)sulfonyl-5-nitroindole 5-nitro-1-(p-tolylsulfonyl)indole 1-(4-methylphenyl)sulfonyl-5-nitro-indole
Comments Less than 3 mono-isotopic peaks
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Formula C15H12N2O4S
InChI InChI=1S/C15H12N2O4S/c1-11-2-5-14(6-3-11)22(20,21)16-9-8-12-10-13(17(18)19)4-7-15(12)16/h2-10H,1H3
InChIKey LNSITYAYVOYMGC-UHFFFAOYSA-N
Molecular Weight 316.331 g/mol
SMILES c12[n](S(c3ccc(cc3)C)(=O)=O)ccc1cc(N(=O)=O)cc2
SPLASH splash10-014i-0009000000-4ea5517fb47167f1aa6c
Source of Spectrum E1-57-799-3a
Wiley ID 1661705