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1,3,8-Triazaspiro[4.5]decan-4-one, 8-[4-(p-fluorophenyl)butyl]-1-phenyl-
SpectraBase Compound ID CqWNE87fL3e
InChI InChI=1S/C23H28FN3O/c24-20-11-9-19(10-12-20)6-4-5-15-26-16-13-23(14-17-26)22(28)25-18-27(23)21-7-2-1-3-8-21/h1-3,7-12H,4-6,13-18H2,(H,25,28)
InChIKey NNXYSTMMMHUVPK-UHFFFAOYSA-N
Mol Weight 381.5 g/mol
Molecular Formula C23H28FN3O
Exact Mass 381.221641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKH3Yv5SCuI
Name 1,3,8-Triazaspiro[4.5]decan-4-one, 8-[4-(p-fluorophenyl)butyl]-1-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.221640696 u
Formula C23H28FN3O
InChI InChI=1S/C23H28FN3O/c24-20-11-9-19(10-12-20)6-4-5-15-26-16-13-23(14-17-26)22(28)25-18-27(23)21-7-2-1-3-8-21/h1-3,7-12H,4-6,13-18H2,(H,25,28)
InChIKey NNXYSTMMMHUVPK-UHFFFAOYSA-N
Molecular Weight 381.495 g/mol
SMILES C(CCN1CCC2(CC1)C(NCN2C1=CC=CC=C1)=O)CC1=CC=C(C=C1)F