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rac-(3aR,5R,7S,7aR)-1-ethyl-3,3,5,7-tetramethyl-5-phenyloctahydrobenzo[c]isoxazole
SpectraBase Compound ID GHugaIkLJ9S
InChI InChI=1S/C19H29NO/c1-6-20-17-14(2)12-19(5,15-10-8-7-9-11-15)13-16(17)18(3,4)21-20/h7-11,14,16-17H,6,12-13H2,1-5H3/t14-,16+,17+,19+/m0/s1
InChIKey VQJKIXAQKARKKE-KNIMUDFMSA-N
Mol Weight 287.45 g/mol
Molecular Formula C19H29NO
Exact Mass 287.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1DFkvDLBmi
Name rac-(3aR,5R,7S,7aR)-1-ethyl-3,3,5,7-tetramethyl-5-phenyloctahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C19H29NO
InChI InChI=1S/C19H29NO/c1-6-20-17-14(2)12-19(5,15-10-8-7-9-11-15)13-16(17)18(3,4)21-20/h7-11,14,16-17H,6,12-13H2,1-5H3/t14-,16+,17+,19+/m0/s1
InChIKey VQJKIXAQKARKKE-KNIMUDFMSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 287.447 g/mol
SMILES C(N1OC([C@]2([C@]1([C@](C[C@](C2)(c1ccccc1)C)(C)[H])[H])[H])(C)C)C
SPLASH splash10-00r6-1930000000-63dc3decbbc90998028b
Source of Spectrum CN114761385A
Wiley ID 1884602