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1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-[(2-chlorophenoxy)methyl]-
SpectraBase Compound ID A9igFd78pnj
InChI InChI=1S/C16H11ClN2O4/c17-11-3-1-2-4-12(11)20-8-15-18-16(19-23-15)10-5-6-13-14(7-10)22-9-21-13/h1-7H,8-9H2
InChIKey IEGWPRSEGXMRLJ-UHFFFAOYSA-N
Mol Weight 330.73 g/mol
Molecular Formula C16H11ClN2O4
Exact Mass 330.040735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8r529HTuztO
Name 1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-[(2-chlorophenoxy)methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.040734538 u
Formula C16H11ClN2O4
InChI InChI=1S/C16H11ClN2O4/c17-11-3-1-2-4-12(11)20-8-15-18-16(19-23-15)10-5-6-13-14(7-10)22-9-21-13/h1-7H,8-9H2
InChIKey IEGWPRSEGXMRLJ-UHFFFAOYSA-N
Molecular Weight 330.727 g/mol
SMILES C=1C2=C(C=CC1C1=NOC(=N1)COC=1C=CC=CC1Cl)OCO2