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4-[5-(4-butoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl]phenyl benzoate

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4-[5-(4-butoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl]phenyl benzoate
SpectraBase Compound ID 9tEMgKK4wDi
InChI InChI=1S/C34H30N2O6/c1-2-3-22-40-27-20-16-25(17-21-27)35-32(37)29-30(36(42-31(29)33(35)38)26-12-8-5-9-13-26)23-14-18-28(19-15-23)41-34(39)24-10-6-4-7-11-24/h4-21,29-31H,2-3,22H2,1H3
InChIKey UJKPEIUPKIPDQJ-UHFFFAOYSA-N
Mol Weight 562.6 g/mol
Molecular Formula C34H30N2O6
Exact Mass 562.210387 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5LLIZGA6sM6
Name 4-[5-(4-butoxyphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl]phenyl benzoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C34H30N2O6/c1-2-3-22-40-27-20-16-25(17-21-27)35-32(37)29-30(36(42-31(29)33(35)38)26-12-8-5-9-13-26)23-14-18-28(19-15-23)41-34(39)24-10-6-4-7-11-24/h4-21,29-31H,2-3,22H2,1H3
InChIKey UJKPEIUPKIPDQJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23477
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D40908; Labnumber: VLM_NM-0409; SBI_ID: SBI-023481
Temperature 308 °C