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2-Methyl-3-[1-dodecenyl]-6,7-methylenedioxy-4[1H]-quinolone
SpectraBase Compound ID 5E1Zd9UgI8g
InChI InChI=1S/C23H31NO3/c1-3-4-5-6-7-8-9-10-11-12-13-18-17(2)24-20-15-22-21(26-16-27-22)14-19(20)23(18)25/h12-15H,3-11,16H2,1-2H3,(H,24,25)/b13-12+
InChIKey SMUHNFHNSSWRSO-OUKQBFOZSA-N
Mol Weight 369.51 g/mol
Molecular Formula C23H31NO3
Exact Mass 369.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BGallNF78jk
Name 2-Methyl-3-[1-dodecenyl]-6,7-methylenedioxy-4[1H]-quinolone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.230393859 u
Formula C23H31NO3
InChI InChI=1S/C23H31NO3/c1-3-4-5-6-7-8-9-10-11-12-13-18-17(2)24-20-15-22-21(26-16-27-22)14-19(20)23(18)25/h12-15H,3-11,16H2,1-2H3,(H,24,25)/b13-12+
InChIKey SMUHNFHNSSWRSO-OUKQBFOZSA-N
Molecular Weight 369.505 g/mol
SMILES C12=C(C(C(=C(N2)C)\C=C\CCCCCCCCCC)=O)C=C2C(=C1)OCO2