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Etafenone-M (HO-methoxy-) AC

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

Etafenone-M (HO-methoxy-) AC
SpectraBase Compound ID CbQ8ICvEsGS
InChI InChI=1S/C24H31NO5/c1-5-25(6-2)15-16-29-22-10-8-7-9-20(22)21(27)13-11-19-12-14-23(28-4)24(17-19)30-18(3)26/h7-10,12,14,17H,5-6,11,13,15-16H2,1-4H3
InChIKey AYYFCPGCODCMFC-UHFFFAOYSA-N
Mol Weight 413.51 g/mol
Molecular Formula C24H31NO5
Exact Mass 413.220223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qAInn05q51
Name Etafenone-m (ho-methoxy-) ac P1488
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.220223097 u
Formula C24H31NO5
InChI InChI=1S/C24H31NO5/c1-5-25(6-2)15-16-29-22-10-8-7-9-20(22)21(27)13-11-19-12-14-23(28-4)24(17-19)30-18(3)26/h7-10,12,14,17H,5-6,11,13,15-16H2,1-4H3
InChIKey AYYFCPGCODCMFC-UHFFFAOYSA-N
Molecular Weight 413.514 g/mol
SMILES C=1C=C(C(=O)CCC=2C=C(OC(C)=O)C(=CC2)OC)C(=CC1)OCCN(CC)CC