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3-[4-(1-adamantyl)piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one
SpectraBase Compound ID FDnXOx6ZMmr
InChI InChI=1S/C25H30N2O4/c1-30-21-4-2-3-19-12-20(24(29)31-22(19)21)23(28)26-5-7-27(8-6-26)25-13-16-9-17(14-25)11-18(10-16)15-25/h2-4,12,16-18H,5-11,13-15H2,1H3
InChIKey JZDRUCGULJGQAD-UHFFFAOYSA-N
Mol Weight 422.53 g/mol
Molecular Formula C25H30N2O4
Exact Mass 422.220557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bRPi5PsLtK
Name 3-[4-(1-adamantyl)piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N2O4
InChI InChI=1S/C25H30N2O4/c1-30-21-4-2-3-19-12-20(24(29)31-22(19)21)23(28)26-5-7-27(8-6-26)25-13-16-9-17(14-25)11-18(10-16)15-25/h2-4,12,16-18H,5-11,13-15H2,1H3
InChIKey JZDRUCGULJGQAD-UHFFFAOYSA-N
Molecular Weight 422.525 g/mol
SMILES C12(N3CCN(CC3)C(C=3C(Oc4c(C3)cccc4OC)=O)=O)CC3CC(CC(C1)C3)C2
SPLASH splash10-0f9l-2930000000-51e0cf33555c6a9d834e
Synonyms 3-[4-(1-adamantyl)piperazine-1-carbonyl]-8-methoxy-chromen-2-one 3-[4-(1-adamantyl)piperazine-1-carbonyl]-8-methoxy-coumarin 3-[[4-(1-adamantyl)-1-piperazinyl]-oxomethyl]-8-methoxy-1-benzopyran-2-one
Wiley ID 1443503