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3-(4-morpholinyl)-N-[6-[[3-(4-morpholinyl)-1-oxopropyl]amino]-9,10-dioxo-2-anthracenyl]propanamide
SpectraBase Compound ID 3fyFWIX1g6n
InChI InChI=1S/C28H32N4O6/c33-25(5-7-31-9-13-37-14-10-31)29-19-1-3-21-23(17-19)28(36)22-4-2-20(18-24(22)27(21)35)30-26(34)6-8-32-11-15-38-16-12-32/h1-4,17-18H,5-16H2,(H,29,33)(H,30,34)
InChIKey MNNVTJGXKLOOHK-UHFFFAOYSA-N
Mol Weight 520.6 g/mol
Molecular Formula C28H32N4O6
Exact Mass 520.232185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FNKfGOXRnqb
Name 3-(4-Morpholinyl)-N-[6-[[3-(4-morpholinyl)-1-oxopropyl]amino]-9,10-dioxo-2-anthracenyl]propanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 520.232184760 u
Formula C28H32N4O6
InChI InChI=1S/C28H32N4O6/c33-25(5-7-31-9-13-37-14-10-31)29-19-1-3-21-23(17-19)28(36)22-4-2-20(18-24(22)27(21)35)30-26(34)6-8-32-11-15-38-16-12-32/h1-4,17-18H,5-16H2,(H,29,33)(H,30,34)
InChIKey MNNVTJGXKLOOHK-UHFFFAOYSA-N
Molecular Weight 520.586 g/mol
SMILES C=12C(C3=CC=C(NC(CCN4CCOCC4)=O)C=C3C(C1C=CC(NC(CCN1CCOCC1)=O)=C2)=O)=O