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rac-(3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyl-5-(5-methylthiophen-3-yl)octahydrobenzo[c]Isoxazole
SpectraBase Compound ID 4OjqhmWCvfN
InChI InChI=1S/C17H27NOS/c1-11-8-17(5,13-7-12(2)20-10-13)9-14-15(11)18(6)19-16(14,3)4/h7,10-11,14-15H,8-9H2,1-6H3/t11-,14+,15+,17+/m0/s1
InChIKey JDZNTRMCEAIKIL-LDXOSZSPSA-N
Mol Weight 293.47 g/mol
Molecular Formula C17H27NOS
Exact Mass 293.181336 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmDnpq7Ntsy
Name rac-(3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyl-5-(5-methylthiophen-3-yl)octahydrobenzo[c]Isoxazole
Appearance Colorless oil
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Formula C17H27NOS
InChI InChI=1S/C17H27NOS/c1-11-8-17(5,13-7-12(2)20-10-13)9-14-15(11)18(6)19-16(14,3)4/h7,10-11,14-15H,8-9H2,1-6H3/t11-,14+,15+,17+/m0/s1
InChIKey JDZNTRMCEAIKIL-LDXOSZSPSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 293.469 g/mol
SMILES C1(ON([C@]2([C@]1(C[C@@](C[C@@]2(C)[H])(c1csc(c1)C)C)[H])[H])C)(C)C
SPLASH splash10-002s-5910000000-b8528d29a85baf1d06a4
Source of Spectrum CN114761385A
Wiley ID 1884412