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3-quinazolineacetamide, 3,4-dihydro-alpha-methyl-4-oxo-N-(4-phenoxyphenyl)-, (alpha~3~S)-
SpectraBase Compound ID D8JQApdvoc3
InChI InChI=1S/C23H19N3O3/c1-16(26-15-24-21-10-6-5-9-20(21)23(26)28)22(27)25-17-11-13-19(14-12-17)29-18-7-3-2-4-8-18/h2-16H,1H3,(H,25,27)
InChIKey BRUAGEBQFGVDLP-UHFFFAOYSA-N
Mol Weight 385.42 g/mol
Molecular Formula C23H19N3O3
Exact Mass 385.142641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EphksXGy4JB
Name 3-Quinazolineacetamide, 3,4-dihydro-alpha-methyl-4-oxo-N-(4-phenoxyphenyl)-, (alpha~3~S)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.142641481 u
Formula C23H19N3O3
InChI InChI=1S/C23H19N3O3/c1-16(26-15-24-21-10-6-5-9-20(21)23(26)28)22(27)25-17-11-13-19(14-12-17)29-18-7-3-2-4-8-18/h2-16H,1H3,(H,25,27)
InChIKey BRUAGEBQFGVDLP-UHFFFAOYSA-N
Molecular Weight 385.423 g/mol
SMILES N(C(C(N1C(C2=CC=CC=C2N=C1)=O)C)=O)C=1C=CC(OC=2C=CC=CC2)=CC1