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3-(2-aminophenyl)prop-2-yn-1-yl acetate
SpectraBase Compound ID 9T82t2gTjae
InChI InChI=1S/C11H11NO2/c1-9(13)14-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7H,8,12H2,1H3
InChIKey GNQNEWXHZQXHCS-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C11H11NO2
Exact Mass 189.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2P3xuedbBw
Name 3-(2-aminophenyl)prop-2-yn-1-yl acetate
Appearance Orange oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.078978596 u
Formula C11H11NO2
InChI InChI=1S/C11H11NO2/c1-9(13)14-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7H,8,12H2,1H3
InChIKey GNQNEWXHZQXHCS-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201132
Quality 96
Reported Formula C11H11NO2
SMILES NC1=C(C=CC=C1)C#CCOC(C)=O
SPLASH splash10-003i-0900000000-cee65db10a9841e2b6c9
Source of Spectrum K1-26-SM15-11f (DOI: 10.1002/ejoc.202201132)
Thin-Layer Chromatography 0.08 (cHex/EtOAc, 10:1)
Wiley ID 1910469