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3-(4-Methyl-benzoyl)-6-(piperidine-1-sulfonyl)-3H-benzooxazol-2-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(4-Methyl-benzoyl)-6-(piperidine-1-sulfonyl)-3H-benzooxazol-2-one
SpectraBase Compound ID B6ZjANLXLCR
InChI InChI=1S/C20H20N2O5S/c1-14-5-7-15(8-6-14)19(23)22-17-10-9-16(13-18(17)27-20(22)24)28(25,26)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3
InChIKey MGPMJFBGMYSROT-UHFFFAOYSA-N
Mol Weight 400.45 g/mol
Molecular Formula C20H20N2O5S
Exact Mass 400.109293 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Izj7exuDndE
Name 2(3H)-benzoxazolone, 3-(4-methylbenzoyl)-6-(1-piperidinylsulfonyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.109292921 u
Formula C20H20N2O5S
InChI InChI=1S/C20H20N2O5S/c1-14-5-7-15(8-6-14)19(23)22-17-10-9-16(13-18(17)27-20(22)24)28(25,26)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3
InChIKey MGPMJFBGMYSROT-UHFFFAOYSA-N
Molecular Weight 400.449 g/mol
NMR Offset 17.9888
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11330
Solvent CDCl3
Source Vendor ID: NMR/10261299; Lab Info: NP; Lab Number: NP-G000268