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4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}morpholine
SpectraBase Compound ID IGH92N0lefW
InChI InChI=1S/C17H23N3O4/c21-17(20-7-9-22-10-8-20)19-5-3-18(4-6-19)12-14-1-2-15-16(11-14)24-13-23-15/h1-2,11H,3-10,12-13H2
InChIKey UOCIBVXSMNJOKT-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C17H23N3O4
Exact Mass 333.168856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5P31WNCAcC0
Name 4-{[4-(1,3-Benzodioxol-5-ylmethyl)-1-piperazinyl]carbonyl}morpholine
Comments Computed using HOSE algorithm
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Exact Mass 333.168856229 u
Formula C17H23N3O4
InChI InChI=1S/C17H23N3O4/c21-17(20-7-9-22-10-8-20)19-5-3-18(4-6-19)12-14-1-2-15-16(11-14)24-13-23-15/h1-2,11H,3-10,12-13H2
InChIKey UOCIBVXSMNJOKT-UHFFFAOYSA-N
Molecular Weight 333.388 g/mol
SMILES C(N1CCN(CC1)CC1=CC=2OCOC2C=C1)(N1CCOCC1)=O