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rac-(3aR,5R,7S,7aR)-1-ethyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazole
SpectraBase Compound ID EsCplu4wjSH
InChI InChI=1S/C13H25NO/c1-6-14-12-10(3)7-9(2)8-11(12)13(4,5)15-14/h9-12H,6-8H2,1-5H3/t9-,10+,11-,12-/m1/s1
InChIKey RCTLLUOIECQEEQ-WRWGMCAJSA-N
Mol Weight 211.35 g/mol
Molecular Formula C13H25NO
Exact Mass 211.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7I8erYdkaNX
Name rac-(3aR,5R,7S,7aR)-1-ethyl-3,3,5,7-tetramethyloctahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C13H25NO
InChI InChI=1S/C13H25NO/c1-6-14-12-10(3)7-9(2)8-11(12)13(4,5)15-14/h9-12H,6-8H2,1-5H3/t9-,10+,11-,12-/m1/s1
InChIKey RCTLLUOIECQEEQ-WRWGMCAJSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 211.349 g/mol
SMILES C(N1OC([C@]2([C@]1([C@](C[C@](C2)(C)[H])(C)[H])[H])[H])(C)C)C
SPLASH splash10-0002-0910000000-9e94394d7e579acc7906
Source of Spectrum CN114761385A
Wiley ID 1884465