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1-(4-Methoxyphenyl)-4-[(5-methyl-3-isoxazolyl)carbonyl]piperazine
SpectraBase Compound ID GPvLVDUBUJt
InChI InChI=1S/C16H19N3O3/c1-12-11-15(17-22-12)16(20)19-9-7-18(8-10-19)13-3-5-14(21-2)6-4-13/h3-6,11H,7-10H2,1-2H3
InChIKey KAXNXZQKVKXPMY-UHFFFAOYSA-N
Mol Weight 301.35 g/mol
Molecular Formula C16H19N3O3
Exact Mass 301.142641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gs3cFibeKlt
Name 1-(4-Methoxyphenyl)-4-[(5-methyl-3-isoxazolyl)carbonyl]piperazine
Comments Computed using HOSE algorithm
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Exact Mass 301.142641481 u
Formula C16H19N3O3
InChI InChI=1S/C16H19N3O3/c1-12-11-15(17-22-12)16(20)19-9-7-18(8-10-19)13-3-5-14(21-2)6-4-13/h3-6,11H,7-10H2,1-2H3
InChIKey KAXNXZQKVKXPMY-UHFFFAOYSA-N
Molecular Weight 301.346 g/mol
SMILES C1(=NOC(=C1)C)C(N1CCN(CC1)C=1C=CC(=CC1)OC)=O