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1-(3-(5-isopropyl-2-methylphenoxy)propyl)quinoxalin-2(1H)-one
SpectraBase Compound ID JpJ9f3XKeps
InChI InChI=1S/C21H24N2O2/c1-15(2)17-10-9-16(3)20(13-17)25-12-6-11-23-19-8-5-4-7-18(19)22-14-21(23)24/h4-5,7-10,13-15H,6,11-12H2,1-3H3
InChIKey VEDAGSABZYZUCC-UHFFFAOYSA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H24N2O2
Exact Mass 336.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1Az01BsiFs
Name 1-(3-(5-isopropyl-2-methylphenoxy)propyl)quinoxalin-2(1H)-one
Appearance Colorless solid
Carrier Gas Helium (2 mL/min)
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Exact Mass 336.183778019 u
Formula C21H24N2O2
GC Column HP-5 (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300 oC
InChI InChI=1S/C21H24N2O2/c1-15(2)17-10-9-16(3)20(13-17)25-12-6-11-23-19-8-5-4-7-18(19)22-14-21(23)24/h4-5,7-10,13-15H,6,11-12H2,1-3H3
InChIKey VEDAGSABZYZUCC-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201484
Molecular Weight 336.435 g/mol
Quality 43
SMILES C1=CC2=C(C=C1)N(C(C=N2)=O)CCCOC1=C(C=CC(=C1)C(C)C)C
SPLASH splash10-000i-0900000000-91398dd521cf09b98bd6
Source of Spectrum K1-26-SM5-1n (DOI: 10.1002/ejoc.202201484)
Thin-Layer Chromatography 0.43 (n-Hexane/EtOAc, 7:3)
Wiley ID 1911468