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1H-Indole, 3-methyl-2-(3-nitrophenyl)-
SpectraBase Compound ID BTfFPlLnJAN
InChI InChI=1S/C15H12N2O2/c1-10-13-7-2-3-8-14(13)16-15(10)11-5-4-6-12(9-11)17(18)19/h2-9,16H,1H3
InChIKey QSRHCDFJLPBZSP-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C15H12N2O2
Exact Mass 252.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ibEih6J3d4
Name 1H-Indole, 3-methyl-2-(3-nitrophenyl)-
Alternate Name(s) 3-Methyl-2-(3-nitrophenyl)-1H-indole
CAS Registry Number 113613-40-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12N2O2
InChI InChI=1S/C15H12N2O2/c1-10-13-7-2-3-8-14(13)16-15(10)11-5-4-6-12(9-11)17(18)19/h2-9,16H,1H3
InChIKey QSRHCDFJLPBZSP-UHFFFAOYSA-N
Molecular Weight 252.273 g/mol
SMILES [nH]1c2ccccc2c(c1-c1cc(N(=O)=O)ccc1)C
SPLASH splash10-0udi-1290000000-5af7970f1195992ae153
Source of Spectrum Y-24-1119-24
Wiley ID 1255734