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rac-(3aR,5R,7S,7aR)-5-(2-ethylphenyl)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazole
SpectraBase Compound ID ICEZ6HhMTGg
InChI InChI=1S/C20H31NO/c1-7-15-10-8-9-11-16(15)20(5)12-14(2)18-17(13-20)19(3,4)22-21(18)6/h8-11,14,17-18H,7,12-13H2,1-6H3/t14-,17+,18+,20+/m0/s1
InChIKey RYFQLOLJJDPFCC-LMVHDODDSA-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 DQOD0FEO3ul
Name rac-(3aR,5R,7S,7aR)-5-(2-ethylphenyl)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-7-15-10-8-9-11-16(15)20(5)12-14(2)18-17(13-20)19(3,4)22-21(18)6/h8-11,14,17-18H,7,12-13H2,1-6H3/t14-,17+,18+,20+/m0/s1
InChIKey RYFQLOLJJDPFCC-LMVHDODDSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 301.474 g/mol
SMILES c1ccc(c(c1)[C@]1(C[C@@]2([C@](N(OC2(C)C)C)([C@](C1)(C)[H])[H])[H])C)CC
SPLASH splash10-0ufr-2903000000-8e1bfacba563a8ed7e3c
Source of Spectrum CN114761385A
Wiley ID 1884378