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5-Methoxy-2-n-octyl-1-(pyridin-2-yl)-1H-indole
SpectraBase Compound ID 5axz6stboLc
InChI InChI=1S/C22H28N2O/c1-3-4-5-6-7-8-11-19-16-18-17-20(25-2)13-14-21(18)24(19)22-12-9-10-15-23-22/h9-10,12-17H,3-8,11H2,1-2H3
InChIKey IDCNQWNFWKPLFX-UHFFFAOYSA-N
Mol Weight 336.48 g/mol
Molecular Formula C22H28N2O
Exact Mass 336.220164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2d67f61JEH6
Name 5-Methoxy-2-n-octyl-1-(pyridin-2-yl)-1H-indole
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.220163529 u
Formula C22H28N2O
InChI InChI=1S/C22H28N2O/c1-3-4-5-6-7-8-11-19-16-18-17-20(25-2)13-14-21(18)24(19)22-12-9-10-15-23-22/h9-10,12-17H,3-8,11H2,1-2H3
InChIKey IDCNQWNFWKPLFX-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704196
Molecular Weight 336.479 g/mol
Reported Formula C22H28N2O
SMILES C1(=CC2=C(C=C1)N(C(=C2)CCCCCCCC)C1=NC=CC=C1)OC
SPLASH splash10-000i-0093000000-4878f4a4715795e6d40a
Source of Spectrum ACI-56-SM8-3ba (DOI: 10.1002/anie.201704196)
Wiley ID 1896254