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4-(1-Aminoanthraquinon-2-ylcarboxamido)phenyl hexanoate
SpectraBase Compound ID 6eYqR4rgpOp
InChI InChI=1S/C27H24N2O5/c1-2-3-4-9-22(30)34-17-12-10-16(11-13-17)29-27(33)21-15-14-20-23(24(21)28)26(32)19-8-6-5-7-18(19)25(20)31/h5-8,10-15H,2-4,9,28H2,1H3,(H,29,33)
InChIKey VTBXILTZMPDNIX-UHFFFAOYSA-N
Mol Weight 456.5 g/mol
Molecular Formula C27H24N2O5
Exact Mass 456.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qOrlzlXTod
Name 4-(1-Aminoanthraquinon-2-ylcarboxamido)phenyl hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N2O5
InChI InChI=1S/C27H24N2O5/c1-2-3-4-9-22(30)34-17-12-10-16(11-13-17)29-27(33)21-15-14-20-23(24(21)28)26(32)19-8-6-5-7-18(19)25(20)31/h5-8,10-15H,2-4,9,28H2,1H3,(H,29,33)
InChIKey VTBXILTZMPDNIX-UHFFFAOYSA-N
Molecular Weight 456.498 g/mol
SMILES Nc1c2C(c3ccccc3C(c2ccc1C(=O)Nc1ccc(cc1)OC(=O)CCCCC)=O)=O
SPLASH splash10-0udi-7690000000-6bc4edbbff2d0e88d69d
Synonyms 4-([(1-Amino-9,10-dioxo-9,10-dihydro-2-anthracenyl)carbonyl]amino)phenyl hexanoate Hexanoic acid [4-[[(1-amino-9,10-dioxo-2-anthracenyl)-oxomethyl]amino]phenyl] ester [4-[(1-amino-9,10-dioxoanthracene-2-carbonyl)amino]phenyl] hexanoate [4-[(1-amino-9,10-dioxo-anthracene-2-carbonyl)amino]phenyl] hexanoate [4-[[1-azanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]phenyl] hexanoate
Wiley ID 1470291