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9H-Fluoren-9-ylmethyl (R)-hexahydro-2-oxo-1H-azepin-3-ylcarbamate

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9H-Fluoren-9-ylmethyl (R)-hexahydro-2-oxo-1H-azepin-3-ylcarbamate
SpectraBase Compound ID n5N8NVnItQ
InChI InChI=1S/C21H22N2O3/c24-20-19(11-5-6-12-22-20)23-21(25)26-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,22,24)(H,23,25)/t19-/m1/s1
InChIKey LXKQOTORHAFWSI-LJQANCHMSA-N
Mol Weight 350.42 g/mol
Molecular Formula C21H22N2O3
Exact Mass 350.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98jB8uO7Qpa
Name 9H-Fluoren-9-ylmethyl (R)-hexahydro-2-oxo-1H-azepin-3-ylcarbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.163042573 u
Formula C21H22N2O3
InChI InChI=1S/C21H22N2O3/c24-20-19(11-5-6-12-22-20)23-21(25)26-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,22,24)(H,23,25)/t19-/m1/s1
InChIKey LXKQOTORHAFWSI-LJQANCHMSA-N
Molecular Weight 350.418 g/mol
SMILES C1(NCCCC[C@]1(NC(=O)OCC1C=2C=CC=CC2C=2C=CC=CC12)[H])=O