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2-Methyl-3-(2-nitro-1-phenyl-ethyl)-1H-indole
SpectraBase Compound ID Lk9BSs3rLg1
InChI InChI=1S/C17H16N2O2/c1-12-17(14-9-5-6-10-16(14)18-12)15(11-19(20)21)13-7-3-2-4-8-13/h2-10,15,18H,11H2,1H3
InChIKey WKSOQILTYQNERT-UHFFFAOYSA-N
Mol Weight 280.33 g/mol
Molecular Formula C17H16N2O2
Exact Mass 280.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PsEhIiLk5b
Name 2-methyl-3-(2-nitro-1-phenylethyl)-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.121177761 u
Formula C17H16N2O2
InChI InChI=1S/C17H16N2O2/c1-12-17(14-9-5-6-10-16(14)18-12)15(11-19(20)21)13-7-3-2-4-8-13/h2-10,15,18H,11H2,1H3
InChIKey WKSOQILTYQNERT-UHFFFAOYSA-N
Instrument Name Agilent 7890 N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202204040
Molecular Weight 280.327 g/mol
Quality 1000
SMILES N1C2=C(C(=C1C)C(C[N+](=O)[O-])C1=CC=CC=C1)C=CC=C2
SPLASH splash10-00lr-1590000000-f2e12bcbc00f34ee1352
Source of Spectrum QE-29-SM7-4a (DOI: 10.1002/chem.202204040)
Wiley ID 1910239