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(E)-4,5,6,7-Tetrahydro-3a-methyl-3-(but-1'-en-3'-ynyl)-2-phenylisoxazolo[2,3-a]pyridine
SpectraBase Compound ID GNHObmQxbKf
InChI InChI=1S/C18H19NO/c1-3-4-12-16-17(15-10-6-5-7-11-15)20-19-14-9-8-13-18(16,19)2/h1,4-7,10-12H,8-9,13-14H2,2H3/b12-4+
InChIKey CRQGJUAVIDZOKT-UUILKARUSA-N
Mol Weight 265.36 g/mol
Molecular Formula C18H19NO
Exact Mass 265.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hq3ESNNS7qq
Name (E)-4,5,6,7-Tetrahydro-3a-methyl-3-(but-1'-en-3'-ynyl)-2-phenylisoxazolo[2,3-a]pyridine
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Formula C18H19NO
InChI InChI=1S/C18H19NO/c1-3-4-12-16-17(15-10-6-5-7-11-15)20-19-14-9-8-13-18(16,19)2/h1,4-7,10-12H,8-9,13-14H2,2H3/b12-4+
InChIKey CRQGJUAVIDZOKT-UUILKARUSA-N
Molecular Weight 265.356 g/mol
SMILES C1(=C(ON2C1(C)CCCC2)c1ccccc1)\C=C\C#C
SPLASH splash10-0a6r-6920000000-34b02bfafe96ab66448a
Source of Spectrum H-84-3832-0
Synonyms 3-[(1E)-1-buten-3-ynyl]-3a-methyl-2-phenyl-4,5,6,7-tetrahydro-3aH-isoxazolo[2,3-a]pyridine
Wiley ID 847860