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rac-(3aR,5R,7S,7aR)-1-isopropyl-3,3,7-trimethyl-5-(3-methylbut-2-en-1-yl)octahydrobenzo[c]isoxazole
SpectraBase Compound ID A4biuOFMavf
InChI InChI=1S/C18H33NO/c1-12(2)8-9-15-10-14(5)17-16(11-15)18(6,7)20-19(17)13(3)4/h8,13-17H,9-11H2,1-7H3/t14-,15+,16+,17+/m0/s1
InChIKey YRYJNAHJMNOIOJ-YLFCFFPRSA-N
Mol Weight 279.5 g/mol
Molecular Formula C18H33NO
Exact Mass 279.256215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeaEp3VchkB
Name rac-(3aR,5R,7S,7aR)-1-isopropyl-3,3,7-trimethyl-5-(3-methylbut-2-en-1-yl)octahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C18H33NO
InChI InChI=1S/C18H33NO/c1-12(2)8-9-15-10-14(5)17-16(11-15)18(6,7)20-19(17)13(3)4/h8,13-17H,9-11H2,1-7H3/t14-,15+,16+,17+/m0/s1
InChIKey YRYJNAHJMNOIOJ-YLFCFFPRSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 279.468 g/mol
SMILES C(N1OC([C@]2([C@]1([C@](C[C@](C2)(CC=C(C)C)[H])(C)[H])[H])[H])(C)C)(C)C
SPLASH splash10-03di-1090000000-5da7222d320aaa05c4b7
Source of Spectrum CN114761385A
Wiley ID 1884472