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 |