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

*Links on SpectraBase are not permalinks.

1,2,3,4-Tetrahydroacetylflazin, methyl(ester)

View entire compound with spectra: 1 NMR

1,2,3,4-Tetrahydroacetylflazin, methyl(ester)
SpectraBase Compound ID BChJgjpyMMa
InChI InChI=1S/C20H20N2O5/c1-11(23)26-10-12-7-8-17(27-12)19-18-14(9-16(22-19)20(24)25-2)13-5-3-4-6-15(13)21-18/h3-8,16,19,21-22H,9-10H2,1-2H3
InChIKey PHXOMQKMRRHFEV-UHFFFAOYSA-N
Mol Weight 368.39 g/mol
Molecular Formula C20H20N2O5
Exact Mass 368.137222 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 DNimgCUjXyd
Name 1,2,3,4-Tetrahydroacetylflazin, methyl(ester)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.137221747 u
Formula C20H20N2O5
InChI InChI=1S/C20H20N2O5/c1-11(23)26-10-12-7-8-17(27-12)19-18-14(9-16(22-19)20(24)25-2)13-5-3-4-6-15(13)21-18/h3-8,16,19,21-22H,9-10H2,1-2H3
InChIKey PHXOMQKMRRHFEV-UHFFFAOYSA-N
Molecular Weight 368.389 g/mol
SMILES C1(NC(CC2=C1NC=1C2=CC=CC1)C(OC)=O)C=1OC(=CC1)COC(C)=O