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trans-4,5-Dihydro-4,4-dimethyl-2-(6-methyl-5-(2-propynyl)-1,3-cyclohexadien-1-yl)oxazole
SpectraBase Compound ID HgUs5YuTd2t
InChI InChI=1S/C15H19NO/c1-5-7-12-8-6-9-13(11(12)2)14-16-15(3,4)10-17-14/h1,6,8-9,11-12H,7,10H2,2-4H3/t11-,12+/m1/s1
InChIKey VIBYSXSRHLNOLU-NEPJUHHUSA-N
Mol Weight 229.32 g/mol
Molecular Formula C15H19NO
Exact Mass 229.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6a5AVrqIMH
Name trans-4,5-Dihydro-4,4-dimethyl-2-(6-methyl-5-(2-propynyl)-1,3-cyclohexadien-1-yl)oxazole
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Formula C15H19NO
InChI InChI=1S/C15H19NO/c1-5-7-12-8-6-9-13(11(12)2)14-16-15(3,4)10-17-14/h1,6,8-9,11-12H,7,10H2,2-4H3/t11-,12+/m1/s1
InChIKey VIBYSXSRHLNOLU-NEPJUHHUSA-N
Molecular Weight 229.323 g/mol
SMILES C1(=NC(C)(C)CO1)C=1[C@@]([C@@](CC#C)(C=CC1)[H])(C)[H]
SPLASH splash10-014l-2900000000-edd9d87b3470fdbe67db
Source of Spectrum J-59-4781-7j
Synonyms trans-4,5-Dihydro-4,4-dimethyl-2-[6-methyl-5-(2-propynyl)-1,3-cyclohexadien-1-yl]oxazole 2-[(5S,6R)-5-(2-propynyl)-6-methyl-1,3-cyclohexadien-1-yl]-4,4-dimethyl-4,5-dihydro-1,3-oxazole
Wiley ID 1230225