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Ethyl 2-[9-(phenyl)-1,2,3,4,5,6,7,8-octahydro-3,3,6,6-tetramethyl-1,8-dioxoacridin-10(9H)-yl]acetate
SpectraBase Compound ID FP2eWiN3clq
InChI InChI=1S/C27H33NO4/c1-6-32-22(31)16-28-18-12-26(2,3)14-20(29)24(18)23(17-10-8-7-9-11-17)25-19(28)13-27(4,5)15-21(25)30/h7-11,23H,6,12-16H2,1-5H3
InChIKey JNRDJHLYDOCDSN-UHFFFAOYSA-N
Mol Weight 435.6 g/mol
Molecular Formula C27H33NO4
Exact Mass 435.240959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L719HnYPLSE
Name Ethyl 2-[9-(phenyl)-1,2,3,4,5,6,7,8-octahydro-3,3,6,6-tetramethyl-1,8-dioxoacridin-10(9H)-yl]acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.240958543 u
Formula C27H33NO4
InChI InChI=1S/C27H33NO4/c1-6-32-22(31)16-28-18-12-26(2,3)14-20(29)24(18)23(17-10-8-7-9-11-17)25-19(28)13-27(4,5)15-21(25)30/h7-11,23H,6,12-16H2,1-5H3
InChIKey JNRDJHLYDOCDSN-UHFFFAOYSA-N
Molecular Weight 435.564 g/mol
SMILES C12=C(N(CC(=O)OCC)C3=C(C2C=2C=CC=CC2)C(CC(C)(C)C3)=O)CC(CC1=O)(C)C