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trans-4,5-Dihydro-4,4-dimethyl-2-[6-ethynylyl-5-(2-propenyl)-1,3-cyclohexadien-1-yl]oxazole
SpectraBase Compound ID BSGuzZeOY2z
InChI InChI=1S/C16H19NO/c1-5-8-12-9-7-10-14(13(12)6-2)15-17-16(3,4)11-18-15/h2,5,7,9-10,12-13H,1,8,11H2,3-4H3/t12-,13+/m1/s1
InChIKey FKMVOPFQJVEMRF-OLZOCXBDSA-N
Mol Weight 241.33 g/mol
Molecular Formula C16H19NO
Exact Mass 241.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kfncTQssMy
Name trans-4,5-Dihydro-4,4-dimethyl-2-[6-ethynylyl-5-(2-propenyl)-1,3-cyclohexadien-1-yl]oxazole
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Formula C16H19NO
InChI InChI=1S/C16H19NO/c1-5-8-12-9-7-10-14(13(12)6-2)15-17-16(3,4)11-18-15/h2,5,7,9-10,12-13H,1,8,11H2,3-4H3/t12-,13+/m1/s1
InChIKey FKMVOPFQJVEMRF-OLZOCXBDSA-N
Molecular Weight 241.334 g/mol
SMILES C1(C=2[C@@](C#C)([C@](CC=C)(C=CC2)[H])[H])=NC(C)(C)CO1
SPLASH splash10-0pbc-3950000000-4ef887eafb97bb34cc24
Source of Spectrum J-59-4781-7
Synonyms 2-[(5R,6R)-5-allyl-6-ethynyl-1,3-cyclohexadien-1-yl]-4,4-dimethyl-4,5-dihydro-1,3-oxazole
Wiley ID 1244334