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2-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)phenyl 4-bromobenzoate

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2-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)phenyl 4-bromobenzoate
SpectraBase Compound ID Dlzi2vVl0iB
InChI InChI=1S/C22H18BrNO4/c23-15-9-7-12(8-10-15)22(27)28-17-4-2-1-3-16(17)24-20(25)18-13-5-6-14(11-13)19(18)21(24)26/h1-4,7-10,13-14,18-19H,5-6,11H2
InChIKey RKLLRLUICMBOFD-UHFFFAOYSA-N
Mol Weight 440.29 g/mol
Molecular Formula C22H18BrNO4
Exact Mass 439.041921 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fO8x5kT92G
Name 2-(3,5-dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)phenyl 4-bromobenzoate
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/C22H18BrNO4/c23-15-9-7-12(8-10-15)22(27)28-17-4-2-1-3-16(17)24-20(25)18-13-5-6-14(11-13)19(18)21(24)26/h1-4,7-10,13-14,18-19H,5-6,11H2
InChIKey RKLLRLUICMBOFD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_463
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: /VSVE0061757; UBI_ID: UBI-000464
Temperature 308 °C