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2-(1-azepanyl)-4-hydroxy-6-phenyl-5-pyrimidinecarbonitrile

View entire compound with spectra: 1 NMR

2-(1-azepanyl)-4-hydroxy-6-phenyl-5-pyrimidinecarbonitrile
SpectraBase Compound ID 5ngjFtzJmUz
InChI InChI=1S/C17H18N4O/c18-12-14-15(13-8-4-3-5-9-13)19-17(20-16(14)22)21-10-6-1-2-7-11-21/h3-5,8-9H,1-2,6-7,10-11H2,(H,19,20,22)
InChIKey OEWDJSAXCIUTRE-UHFFFAOYSA-N
Mol Weight 294.36 g/mol
Molecular Formula C17H18N4O
Exact Mass 294.148061 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KgOabbazYLE
Name 2-(1-azepanyl)-4-hydroxy-6-phenyl-5-pyrimidinecarbonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.148061215 u
Formula C17H18N4O
InChI InChI=1S/C17H18N4O/c18-12-14-15(13-8-4-3-5-9-13)19-17(20-16(14)22)21-10-6-1-2-7-11-21/h3-5,8-9H,1-2,6-7,10-11H2,(H,19,20,22)
InChIKey OEWDJSAXCIUTRE-UHFFFAOYSA-N
Molecular Weight 294.358 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1517
Solvent DMSO-d6
Source Vendor ID: NMR/12269963