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2-{[2-(1-azepanyl)-2-oxoethyl]sulfanyl}-6-hydroxy-4(3H)-pyrimidinone
SpectraBase Compound ID GkG1vBmMuSS
InChI InChI=1S/C12H17N3O3S/c16-9-7-10(17)14-12(13-9)19-8-11(18)15-5-3-1-2-4-6-15/h7H,1-6,8H2,(H2,13,14,16,17)
InChIKey QYINDDSKLRUHRY-UHFFFAOYSA-N
Mol Weight 283.35 g/mol
Molecular Formula C12H17N3O3S
Exact Mass 283.099063 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1bfCOMcbawx
Name 2-{[2-(1-azepanyl)-2-oxoethyl]sulfanyl}-6-hydroxy-4(3H)-pyrimidinone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.099062590 u
Formula C12H17N3O3S
InChI InChI=1S/C12H17N3O3S/c16-9-7-10(17)14-12(13-9)19-8-11(18)15-5-3-1-2-4-6-15/h7H,1-6,8H2,(H2,13,14,16,17)
InChIKey QYINDDSKLRUHRY-UHFFFAOYSA-N
Molecular Weight 283.346 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1412
Solvent DMSO-d6
Source Vendor ID: NMR/12269734