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6-Methyl-2-phenylbenzoxazole
SpectraBase Compound ID KLK3pm1A4Ae
InChI InChI=1S/C14H11NO/c1-10-7-8-12-13(9-10)16-14(15-12)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey HNTGXYVCUNUJGL-UHFFFAOYSA-N
Mol Weight 209.25 g/mol
Molecular Formula C14H11NO
Exact Mass 209.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30TZUPOmICp
Name 6-Methyl-2-phenylbenzoxazole
Appearance Colorless plates
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.084063977 u
Formula C14H11NO
InChI InChI=1S/C14H11NO/c1-10-7-8-12-13(9-10)16-14(15-12)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey HNTGXYVCUNUJGL-UHFFFAOYSA-N
Instrument Name Agilent 5977E Diff-SST MSD-230V
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.18.155
Molecular Weight 209.248 g/mol
Quality 172
Reported Formula C14H11NO
SMILES C=1C(=CC=2OC(=NC2C1)C1=CC=CC=C1)C
SPLASH splash10-0a4i-2290000000-a9d1e204a62ae277dc07
Source of Spectrum BJO-18-SM7-8t (DOI: 10.3762/bjoc.18.155)
Thin-Layer Chromatography 0.4 (Hexane/EtOAc, 9:1)
Wiley ID 1901260