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4(1H)-quinazolinone, 2-(1,3-benzodioxol-5-yl)-3-[[(E)-1,3-benzodioxol-5-ylmethylidene]amino]-2,3-dihydro-7-nitro-
SpectraBase Compound ID JXHuQUt6gMy
InChI InChI=1S/C23H16N4O7/c28-23-16-4-3-15(27(29)30)9-17(16)25-22(14-2-6-19-21(8-14)34-12-32-19)26(23)24-10-13-1-5-18-20(7-13)33-11-31-18/h1-10,22,25H,11-12H2/b24-10+
InChIKey MBMMYJJLVLQIFK-YSURURNPSA-N
Mol Weight 460.4 g/mol
Molecular Formula C23H16N4O7
Exact Mass 460.101899 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID eYsjSjDsFw
Name 4(1H)-quinazolinone, 2-(1,3-benzodioxol-5-yl)-3-[[(E)-1,3-benzodioxol-5-ylmethylidene]amino]-2,3-dihydro-7-nitro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.101898864 u
Formula C23H16N4O7
InChI InChI=1S/C23H16N4O7/c28-23-16-4-3-15(27(29)30)9-17(16)25-22(14-2-6-19-21(8-14)34-12-32-19)26(23)24-10-13-1-5-18-20(7-13)33-11-31-18/h1-10,22,25H,11-12H2/b24-10+
InChIKey MBMMYJJLVLQIFK-YSURURNPSA-N
Molecular Weight 460.402 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10115
Solvent DMSO-d6
Source Vendor ID: ZI/10038089; Lab Info: SN; Lab Number: SN-Z000005