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rac-(3aR,5S,7aR)-1,3,3,5-tetramethyl-5-(3-methylbut-2-en-1-yl)octahydrobenzo[c]Isoxazole
SpectraBase Compound ID 9zNNbZqQdDp
InChI InChI=1S/C16H29NO/c1-12(2)7-9-16(5)10-8-14-13(11-16)15(3,4)18-17(14)6/h7,13-14H,8-11H2,1-6H3/t13-,14-,16-/m1/s1
InChIKey VYPMRRONMCWCBO-IIAWOOMASA-N
Mol Weight 251.41 g/mol
Molecular Formula C16H29NO
Exact Mass 251.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SoxqBSlxEV
Name rac-(3aR,5S,7aR)-1,3,3,5-tetramethyl-5-(3-methylbut-2-en-1-yl)octahydrobenzo[c]Isoxazole
Appearance Pale yellow oil
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Formula C16H29NO
InChI InChI=1S/C16H29NO/c1-12(2)7-9-16(5)10-8-14-13(11-16)15(3,4)18-17(14)6/h7,13-14H,8-11H2,1-6H3/t13-,14-,16-/m1/s1
InChIKey VYPMRRONMCWCBO-IIAWOOMASA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 251.414 g/mol
SMILES C1(ON([C@]2([C@]1(C[C@@](CC2)(CC=C(C)C)C)[H])[H])C)(C)C
SPLASH splash10-000i-6690000000-9c9bcbcd43c7f992d38f
Source of Spectrum CN114761385A
Wiley ID 1884502