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rac-(3aR,5R,7R,7aR)-1-ethyl-3,3,5,7-tetramethyl-5-(o-tolyl)octahydrobenzo[c]isoxazole
SpectraBase Compound ID E3ijhlCPRuN
InChI InChI=1S/C20H31NO/c1-7-21-18-15(3)12-20(6,13-17(18)19(4,5)22-21)16-11-9-8-10-14(16)2/h8-11,15,17-18H,7,12-13H2,1-6H3/t15-,17-,18-,20-/m1/s1
InChIKey JARKEKQGLJENJW-DLVXIWMQSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RooKSJkrnO
Name rac-(3aR,5R,7R,7aR)-1-ethyl-3,3,5,7-tetramethyl-5-(o-tolyl)octahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-7-21-18-15(3)12-20(6,13-17(18)19(4,5)22-21)16-11-9-8-10-14(16)2/h8-11,15,17-18H,7,12-13H2,1-6H3/t15-,17-,18-,20-/m1/s1
InChIKey JARKEKQGLJENJW-DLVXIWMQSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 301.474 g/mol
SMILES C1(ON([C@]2([C@]1(C[C@@](C[C@]2(C)[H])(c1c(cccc1)C)C)[H])[H])CC)(C)C
SPLASH splash10-000i-0982000000-5ca8d00513c90697bf41
Source of Spectrum CN114761385A
Wiley ID 1884381