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3-[(1E)-buta-1,3-dienyl]-3a,6,6-trimethyl-2-phenyl-4,5-dihydropyrrolo[1,2-b]isoxazole
SpectraBase Compound ID 8zO3mPNrgkw
InChI InChI=1S/C19H23NO/c1-5-6-12-16-17(15-10-8-7-9-11-15)21-20-18(2,3)13-14-19(16,20)4/h5-12H,1,13-14H2,2-4H3/b12-6+
InChIKey BXEPGFLHMGBHNF-WUXMJOGZSA-N
Mol Weight 281.4 g/mol
Molecular Formula C19H23NO
Exact Mass 281.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LiMvyq7tI
Name 3-[(1E)-buta-1,3-dienyl]-3a,6,6-trimethyl-2-phenyl-4,5-dihydropyrrolo[1,2-b]isoxazole
Alternate Name(s) 3-[(1E)-buta-1,3-dienyl]-3a,6,6-trimethyl-2-phenyl-4,5-dihydropyrrolo[1,2-b][1,2]oxazole 3-[(1E)-buta-1,3-dienyl]-3a,6,6-trimethyl-2-phenyl-4,5-dihydropyrrol[1,2-b]isoxazole
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Formula C19H23NO
InChI InChI=1S/C19H23NO/c1-5-6-12-16-17(15-10-8-7-9-11-15)21-20-18(2,3)13-14-19(16,20)4/h5-12H,1,13-14H2,2-4H3/b12-6+
InChIKey BXEPGFLHMGBHNF-WUXMJOGZSA-N
Molecular Weight 281.399 g/mol
SMILES C12(N(OC(=C2\C=C\C=C)c2ccccc2)C(CC1)(C)C)C
SPLASH splash10-05fu-3930000000-21ab66664637bc1b2058
Source of Spectrum KC-57-4354-13
Wiley ID 1624130