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(5-Isopropyl-6-methyl-2-phenylpyrimidin-4-yl)methyl Isobutyrate
SpectraBase Compound ID BWHauulrPK3
InChI InChI=1S/C19H24N2O2/c1-12(2)17-14(5)20-18(15-9-7-6-8-10-15)21-16(17)11-23-19(22)13(3)4/h6-10,12-13H,11H2,1-5H3
InChIKey ZPWSXEUHTVELLP-UHFFFAOYSA-N
Mol Weight 312.41 g/mol
Molecular Formula C19H24N2O2
Exact Mass 312.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNk0WpuU85W
Name (5-Isopropyl-6-methyl-2-phenylpyrimidin-4-yl)methyl Isobutyrate
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.183778019 u
Formula C19H24N2O2
InChI InChI=1S/C19H24N2O2/c1-12(2)17-14(5)20-18(15-9-7-6-8-10-15)21-16(17)11-23-19(22)13(3)4/h6-10,12-13H,11H2,1-5H3
InChIKey ZPWSXEUHTVELLP-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1021/jo400090w
Molecular Weight 312.413 g/mol
Quality 141
SMILES C(C)(C)C=1C(=NC(=NC1C)C1=CC=CC=C1)COC(C(C)C)=O
SPLASH splash10-006x-0191000000-b698c0236201cf92dc4e
Source of Spectrum JOC-78-3462-12 (DOI: 10.1021/jo400090w)
Wiley ID 1912483