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rac-(3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyl-5-phenyloctahydrobenzo[c]isoxazole
SpectraBase Compound ID DtgnJvj2VQI
InChI InChI=1S/C18H27NO/c1-13-11-18(4,14-9-7-6-8-10-14)12-15-16(13)19(5)20-17(15,2)3/h6-10,13,15-16H,11-12H2,1-5H3/t13-,15+,16+,18+/m0/s1
InChIKey XTUAIQSQMZQOPA-AAJLLMFJSA-N
Mol Weight 273.42 g/mol
Molecular Formula C18H27NO
Exact Mass 273.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1k0SHm01YDZ
Name rac-(3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyl-5-phenyloctahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C18H27NO
InChI InChI=1S/C18H27NO/c1-13-11-18(4,14-9-7-6-8-10-14)12-15-16(13)19(5)20-17(15,2)3/h6-10,13,15-16H,11-12H2,1-5H3/t13-,15+,16+,18+/m0/s1
InChIKey XTUAIQSQMZQOPA-AAJLLMFJSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 273.420 g/mol
SMILES CN1OC([C@]2([C@]1([C@](C[C@](C2)(c1ccccc1)C)(C)[H])[H])[H])(C)C
SPLASH splash10-00b9-2930000000-31b240527b018422b52d
Source of Spectrum CN114761385A
Wiley ID 1884600