For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-{[2-(9H-carbazol-9-yl)-2-oxoethyl]sulfanyl}-4-pyrimidinol

View entire compound with spectra: 2 NMR

2-{[2-(9H-carbazol-9-yl)-2-oxoethyl]sulfanyl}-4-pyrimidinol
SpectraBase Compound ID 7jvPSxNq5UV
InChI InChI=1S/C18H13N3O2S/c22-16-9-10-19-18(20-16)24-11-17(23)21-14-7-3-1-5-12(14)13-6-2-4-8-15(13)21/h1-10H,11H2,(H,19,20,22)
InChIKey ITDHFRLALPHWIF-UHFFFAOYSA-N
Mol Weight 335.38 g/mol
Molecular Formula C18H13N3O2S
Exact Mass 335.072848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9Mqf3TYw6rq
Name 2-{[2-(9H-Carbazol-9-yl)-2-oxoethyl]sulfanyl}-4-pyrimidinol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.072847843 u
Formula C18H13N3O2S
InChI InChI=1S/C18H13N3O2S/c22-16-9-10-19-18(20-16)24-11-17(23)21-14-7-3-1-5-12(14)13-6-2-4-8-15(13)21/h1-10H,11H2,(H,19,20,22)
InChIKey ITDHFRLALPHWIF-UHFFFAOYSA-N
Molecular Weight 335.381 g/mol
SMILES OC=1N=C(SCC(N2C3=C(C=CC=C3)C3=C2C=CC=C3)=O)N=CC1