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2-Isopropoxyethyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
SpectraBase Compound ID Jic21R22Nrd
InChI InChI=1S/C24H31NO5/c1-14(2)29-9-10-30-23(28)20-15(3)25-18-12-24(4,5)13-19(27)22(18)21(20)16-7-6-8-17(26)11-16/h6-8,11,14,21,25-26H,9-10,12-13H2,1-5H3
InChIKey UIGNIFYCJZNATB-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 4oQM5btTpeO
Name 2-Isopropoxyethyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
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/c1-14(2)29-9-10-30-23(28)20-15(3)25-18-12-24(4,5)13-19(27)22(18)21(20)16-7-6-8-17(26)11-16/h6-8,11,14,21,25-26H,9-10,12-13H2,1-5H3
InChIKey UIGNIFYCJZNATB-UHFFFAOYSA-N
Molecular Weight 413.514 g/mol
SMILES C=1(C(C=2C(CC(CC2NC1C)(C)C)=O)C1=CC(O)=CC=C1)C(=O)OCCOC(C)C