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

*Links on SpectraBase are not permalinks.
4-Hydroxy-6-methyl-3-(5-phenyl-1-propanoyl-4,5-dihydropyrazol-3-yl)pyran-2-one
SpectraBase Compound ID 344bn7rmGAV
InChI InChI=1S/C18H18N2O4/c1-3-16(22)20-14(12-7-5-4-6-8-12)10-13(19-20)17-15(21)9-11(2)24-18(17)23/h4-9,14,21H,3,10H2,1-2H3
InChIKey CKSSCWHCMGMLHB-UHFFFAOYSA-N
Mol Weight 326.35 g/mol
Molecular Formula C18H18N2O4
Exact Mass 326.126657 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 Dlz2XwIpUH
Name 4-Hydroxy-6-methyl-3-(5-phenyl-1-propanoyl-4,5-dihydropyrazol-3-yl)pyran-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.126657064 u
Formula C18H18N2O4
InChI InChI=1S/C18H18N2O4/c1-3-16(22)20-14(12-7-5-4-6-8-12)10-13(19-20)17-15(21)9-11(2)24-18(17)23/h4-9,14,21H,3,10H2,1-2H3
InChIKey CKSSCWHCMGMLHB-UHFFFAOYSA-N
Molecular Weight 326.352 g/mol
SMILES CC1=CC(=C(C=2CC(N(C(CC)=O)N2)C2=CC=CC=C2)C(O1)=O)O