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4-(2'-methylpropyl)-5-(4'-methylpent-1'-ynyl)-2-oxo-3=[(.alpha.-trifluoromethyl,.alpha.-methoxybenzyl)carbonyl] 2,3,4,,5-tetrahydroxazole
SpectraBase Compound ID Lmqr746bgBr
InChI InChI=1S/C23H28F3NO4/c1-15(2)10-9-13-19-18(14-16(3)4)27(21(29)31-19)20(28)22(30-5,23(24,25)26)17-11-7-6-8-12-17/h6-8,11-12,15-16,18-19H,10,14H2,1-5H3
InChIKey IBWZZWZEBHTOBI-UHFFFAOYSA-N
Mol Weight 439.48 g/mol
Molecular Formula C23H28F3NO4
Exact Mass 439.197043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LEh71fpZRZ
Name 4-(2'-methylpropyl)-5-(4'-methylpent-1'-ynyl)-2-oxo-3=[(.alpha.-trifluoromethyl,.alpha.-methoxybenzyl)carbonyl] 2,3,4,,5-tetrahydroxazole
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Formula C23H28F3NO4
InChI InChI=1S/C23H28F3NO4/c1-15(2)10-9-13-19-18(14-16(3)4)27(21(29)31-19)20(28)22(30-5,23(24,25)26)17-11-7-6-8-12-17/h6-8,11-12,15-16,18-19H,10,14H2,1-5H3
InChIKey IBWZZWZEBHTOBI-UHFFFAOYSA-N
Molecular Weight 439.475 g/mol
SMILES C1(N(C(C(O1)C#CCC(C)C)CC(C)C)C(C(C(F)(F)F)(c1ccccc1)OC)=O)=O
SPLASH splash10-000i-5900100000-664b3bbea7f7d2247967
Source of Spectrum UW-0-0-18
Synonyms 4-isobutyl-5-(4-methyl-1-pentynyl)-3-(3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl)-1,3-oxazolidin-2-one
Wiley ID 241745