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3-(N-Acetylamino)-2-phenylethylindole
SpectraBase Compound ID AwOY4Uk7P7n
InChI InChI=1S/C18H18N2O/c1-13(21)19-18-15-9-5-6-10-16(15)20-17(18)12-11-14-7-3-2-4-8-14/h2-10,20H,11-12H2,1H3,(H,19,21)
InChIKey PUSJXBNFKUFYCT-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C18H18N2O
Exact Mass 278.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuZXYw95Y2B
Name 3-(N-Acetylamino)-2-phenylethylindole
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.141913207 u
Formula C18H18N2O
InChI InChI=1S/C18H18N2O/c1-13(21)19-18-15-9-5-6-10-16(15)20-17(18)12-11-14-7-3-2-4-8-14/h2-10,20H,11-12H2,1H3,(H,19,21)
InChIKey PUSJXBNFKUFYCT-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/anie.201702310
Molecular Weight 278.355 g/mol
Quality 105
Reported Formula C18H18ON2
SMILES N(C(C)=O)C1=C(NC2=CC=CC=C12)CCC1=CC=CC=C1
SPLASH splash10-000i-0930000000-fb1cba9c112c1627f1a5
Source of Spectrum ACI-56-SM28-18 (DOI: 10.1002/anie.201702310)
Thin-Layer Chromatography 0.1 (cyclohexane/EtOAc, 1:1)
Wiley ID 1895912