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2-(4-Nitrophenyl)-6,7,8,9-tetrahydrothieno[3',2':4,5]pyrimido[1,2-a]azepin-11(5H)-one
SpectraBase Compound ID 50xxSmCPYP9
InChI InChI=1S/C17H15N3O3S/c21-17-16-13(18-15-4-2-1-3-9-19(15)17)10-14(24-16)11-5-7-12(8-6-11)20(22)23/h5-8,10H,1-4,9H2
InChIKey QNPSCYJECJQBII-UHFFFAOYSA-N
Mol Weight 341.39 g/mol
Molecular Formula C17H15N3O3S
Exact Mass 341.083413 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5dJz5xTOizy
Name thieno[3',2':4,5]pyrimido[1,2-a]azepin-11(5H)-one, 6,7,8,9-tetrahydro-2-(4-nitrophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 341.083412526 u
Formula C17H15N3O3S
InChI InChI=1S/C17H15N3O3S/c21-17-16-13(18-15-4-2-1-3-9-19(15)17)10-14(24-16)11-5-7-12(8-6-11)20(22)23/h5-8,10H,1-4,9H2
InChIKey QNPSCYJECJQBII-UHFFFAOYSA-N
Molecular Weight 341.385 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1045
Solvent DMSO-d6
Source Vendor ID: ZI/8056124; Lab Info: HT; Lab Number: HT-0000077
Temperature 29.85 °C