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4-[3-acetyl-4-(morpholin-4-yl)phenyl]-8,9-dibromo-4-azatricyclo[5.2.1.0(2,6)]decane-3,5-dion
SpectraBase Compound ID 1HGQzsz3azg
InChI InChI=1S/C20H20Br2N2O5/c21-16-11-8-12(17(16)22)15-14(11)18(25)24(19(15)26)9-1-2-13(10(7-9)20(27)28)23-3-5-29-6-4-23/h1-2,7,11-12,14-17H,3-6,8H2,(H,27,28)
InChIKey QBUWWUNLFBZXMM-UHFFFAOYSA-N
Mol Weight 528.2 g/mol
Molecular Formula C20H20Br2N2O5
Exact Mass 525.973898 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I9OBbVcoQLj
Name 4-[3-acetyl-4-(morpholin-4-yl)phenyl]-8,9-dibromo-4-azatricyclo[5.2.1.0(2,6)]decane-3,5-dion
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 525.973897747 u
Formula C20H20Br2N2O5
InChI InChI=1S/C20H20Br2N2O5/c21-16-11-8-12(17(16)22)15-14(11)18(25)24(19(15)26)9-1-2-13(10(7-9)20(27)28)23-3-5-29-6-4-23/h1-2,7,11-12,14-17H,3-6,8H2,(H,27,28)
InChIKey QBUWWUNLFBZXMM-UHFFFAOYSA-N
Molecular Weight 528.197 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9622
Solvent DMSO-d6
Source Vendor ID: NMR/10240681; Lab Info: KWN; Lab Number: KWN-JW00244