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2-n-Butyl-3-(p-toluenesulfonyl)-4,5,6,7-tetrahydro-3aH-isoxazolo[2,3-a]pyridine
SpectraBase Compound ID BOcZlx6mSiR
InChI InChI=1S/C18H25NO3S/c1-3-4-8-17-18(16-7-5-6-13-19(16)22-17)23(20,21)15-11-9-14(2)10-12-15/h9-12,16H,3-8,13H2,1-2H3
InChIKey DFWPVMJXSQUMCN-UHFFFAOYSA-N
Mol Weight 335.46 g/mol
Molecular Formula C18H25NO3S
Exact Mass 335.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KdYk4KyA8mb
Name 2-n-Butyl-3-(p-toluenesulfonyl)-4,5,6,7-tetrahydro-3aH-isoxazolo[2,3-a]pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C18H25NO3S
InChI InChI=1S/C18H25NO3S/c1-3-4-8-17-18(16-7-5-6-13-19(16)22-17)23(20,21)15-11-9-14(2)10-12-15/h9-12,16H,3-8,13H2,1-2H3
InChIKey DFWPVMJXSQUMCN-UHFFFAOYSA-N
Molecular Weight 335.462 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)=C(ON2C1CCCC2)CCCC
SPLASH splash10-001i-0009000000-f1944f37371272e7c095
Source of Spectrum J-73-8066-56
Wiley ID 1668701