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6-[2-(4-methylphenyl)acetyl]-3-(pyridin-3-ylmethyl)-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-en-4-one
SpectraBase Compound ID KH4ys2SIfPC
InChI InChI=1S/C22H21N3O3/c1-14-4-6-16(7-5-14)24-20(26)18-17-8-9-22(28-17)13-25(21(27)19(18)22)12-15-3-2-10-23-11-15/h2-11,17-19H,12-13H2,1H3,(H,24,26)
InChIKey KKELNQXQWMMKDJ-UHFFFAOYSA-N
Mol Weight 375.43 g/mol
Molecular Formula C22H21N3O3
Exact Mass 375.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Efk5VvsLtLK
Name 6-[2-(4-methylphenyl)acetyl]-3-(pyridin-3-ylmethyl)-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-en-4-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.158291545 u
Formula C22H21N3O3
InChI InChI=1S/C22H21N3O3/c1-14-4-6-16(7-5-14)24-20(26)18-17-8-9-22(28-17)13-25(21(27)19(18)22)12-15-3-2-10-23-11-15/h2-11,17-19H,12-13H2,1H3,(H,24,26)
InChIKey KKELNQXQWMMKDJ-UHFFFAOYSA-N
Molecular Weight 375.428 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5725
Solvent DMSO-d6
Source Vendor ID: NMR/12668773
Temperature 23.85 °C