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

*Links on SpectraBase are not permalinks.

4-Chloro-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine

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

4-Chloro-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
SpectraBase Compound ID 7v52Fo4kIrm
InChI InChI=1S/C19H14ClN3O/c1-24-15-9-7-14(8-10-15)23-11-16(13-5-3-2-4-6-13)17-18(20)21-12-22-19(17)23/h2-12H,1H3
InChIKey ODBFVJIVUPXYGY-UHFFFAOYSA-N
Mol Weight 335.79 g/mol
Molecular Formula C19H14ClN3O
Exact Mass 335.08254 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID JHCnkrVRMEt
Name 4-Chloro-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-D]pyrimidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.082539782 u
Formula C19H14ClN3O
InChI InChI=1S/C19H14ClN3O/c1-24-15-9-7-14(8-10-15)23-11-16(13-5-3-2-4-6-13)17-18(20)21-12-22-19(17)23/h2-12H,1H3
InChIKey ODBFVJIVUPXYGY-UHFFFAOYSA-N
Molecular Weight 335.794 g/mol
SMILES C1=2C(C(C=3C=CC=CC3)=CN1C=1C=CC(=CC1)OC)=C(Cl)N=CN2