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4-{6-methoxy-9-methyl-11-oxo-8-oxa-10,12-diazatricyclo[7.3.1.0²,⁷]trideca-2,4,6-trien-10-yl}-N-(2-phenylethyl)benzamide
SpectraBase Compound ID 986TIp48vFl
InChI InChI=1S/C27H27N3O4/c1-27-17-22(21-9-6-10-23(33-2)24(21)34-27)29-26(32)30(27)20-13-11-19(12-14-20)25(31)28-16-15-18-7-4-3-5-8-18/h3-14,22H,15-17H2,1-2H3,(H,28,31)(H,29,32)
InChIKey HLIWJRVXQHOPRO-UHFFFAOYSA-N
Mol Weight 457.53 g/mol
Molecular Formula C27H27N3O4
Exact Mass 457.200156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CLfflyKR9mB
Name 4-{6-methoxy-9-methyl-11-oxo-8-oxa-10,12-diazatricyclo[7.3.1.0²,⁷]trideca-2,4,6-trien-10-yl}-N-(2-phenylethyl)benzamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.200156357 u
Formula C27H27N3O4
InChI InChI=1S/C27H27N3O4/c1-27-17-22(21-9-6-10-23(33-2)24(21)34-27)29-26(32)30(27)20-13-11-19(12-14-20)25(31)28-16-15-18-7-4-3-5-8-18/h3-14,22H,15-17H2,1-2H3,(H,28,31)(H,29,32)
InChIKey HLIWJRVXQHOPRO-UHFFFAOYSA-N
Molecular Weight 457.530 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7276
Solvent DMSO-d6
Source Vendor ID: NMR/13218012