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2,1,3-benzoxadiazol-4(5H)-one, 6,7-dihydro-, O-[(6-chloro-1,3-benzodioxol-5-yl)methyl]oxime, (4E)-
SpectraBase Compound ID GioSnrcv1qV
InChI InChI=1S/C14H12ClN3O4/c15-9-5-13-12(19-7-20-13)4-8(9)6-21-16-10-2-1-3-11-14(10)18-22-17-11/h4-5H,1-3,6-7H2/b16-10+
InChIKey TYFYPMCSZNJZOE-MHWRWJLKSA-N
Mol Weight 321.72 g/mol
Molecular Formula C14H12ClN3O4
Exact Mass 321.051634 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2P4kpPiTc9t
Name 2,1,3-benzoxadiazol-4(5H)-one, 6,7-dihydro-, O-[(6-chloro-1,3-benzodioxol-5-yl)methyl]oxime, (4E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.051633574 u
Formula C14H12ClN3O4
InChI InChI=1S/C14H12ClN3O4/c15-9-5-13-12(19-7-20-13)4-8(9)6-21-16-10-2-1-3-11-14(10)18-22-17-11/h4-5H,1-3,6-7H2/b16-10+
InChIKey TYFYPMCSZNJZOE-MHWRWJLKSA-N
Molecular Weight 321.720 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14773
Solvent DMSO-d6
Source Vendor ID: NMR/10310677; Lab Info: SAD; Lab Number: 11