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3-[.beta.-Keto-.gamma.-[1-benzoyl-2-piperidiyl]propyl]-4-quinazolone
SpectraBase Compound ID 1z8f99NBbRK
InChI InChI=1S/C23H23N3O3/c27-19(15-25-16-24-21-12-5-4-11-20(21)23(25)29)14-18-10-6-7-13-26(18)22(28)17-8-2-1-3-9-17/h1-5,8-9,11-12,16,18H,6-7,10,13-15H2
InChIKey KKIMKWRSXLUSSR-UHFFFAOYSA-N
Mol Weight 389.46 g/mol
Molecular Formula C23H23N3O3
Exact Mass 389.173942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DVTAXQwZPvV
Name 3-[.beta.-Keto-.gamma.-[1-benzoyl-2-piperidiyl]propyl]-4-quinazolone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.173941610 u
Formula C23H23N3O3
InChI InChI=1S/C23H23N3O3/c27-19(15-25-16-24-21-12-5-4-11-20(21)23(25)29)14-18-10-6-7-13-26(18)22(28)17-8-2-1-3-9-17/h1-5,8-9,11-12,16,18H,6-7,10,13-15H2
InChIKey KKIMKWRSXLUSSR-UHFFFAOYSA-N
Molecular Weight 389.455 g/mol
SMILES C1=CC=CC=C1C(=O)N1CCCCC1CC(=O)CN1C=NC=2C(C1=O)=CC=CC2