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rac-5-(3-methoxypyridin-2-yl)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazole
SpectraBase Compound ID 7fCZSVBbuQN
InChI InChI=1S/C18H28N2O2/c1-12-10-18(4,16-14(21-6)8-7-9-19-16)11-13-15(12)20(5)22-17(13,2)3/h7-9,12-13,15H,10-11H2,1-6H3
InChIKey IBPDDQPVRZUGMF-UHFFFAOYSA-N
Mol Weight 304.43 g/mol
Molecular Formula C18H28N2O2
Exact Mass 304.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UHscp5fPNI
Name rac-5-(3-methoxypyridin-2-yl)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazole
Appearance Pale yellow oil
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Formula C18H28N2O2
InChI InChI=1S/C18H28N2O2/c1-12-10-18(4,16-14(21-6)8-7-9-19-16)11-13-15(12)20(5)22-17(13,2)3/h7-9,12-13,15H,10-11H2,1-6H3
InChIKey IBPDDQPVRZUGMF-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 304.434 g/mol
SMILES C1(CC2C(N(OC2(C)C)C)C(C1)C)(C)c1c(cccn1)OC
SPLASH splash10-0002-9530000000-4dfc0c60042dea3457eb
Sample Comments Isomer 3
Source of Spectrum CN114761385A
Wiley ID 1884430