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8-Methyl-8-oxido-8-azabicyclo[3.2.1]oct-3-yl hydroxy(phenyl)acetate

View entire compound with spectra: 2 NMR

8-Methyl-8-oxido-8-azabicyclo[3.2.1]oct-3-yl hydroxy(phenyl)acetate
SpectraBase Compound ID BDta8GBWqzQ
InChI InChI=1S/C16H21NO4/c1-17(20)12-7-8-13(17)10-14(9-12)21-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13+,14-,15?,17+
InChIKey CRDMNHQVXBRJTR-DDQHRBSASA-N
Mol Weight 291.35 g/mol
Molecular Formula C16H21NO4
Exact Mass 291.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3L25XSNpekg
Name 8-Methyl-8-oxido-8-azabicyclo[3.2.1]oct-3-yl hydroxy(phenyl)acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.147058156 u
Formula C16H21NO4
InChI InChI=1S/C16H21NO4/c1-17(20)12-7-8-13(17)10-14(9-12)21-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13+,14-,15?,17+
InChIKey CRDMNHQVXBRJTR-DDQHRBSASA-N
SMILES OC(C(O[C@]1(C[C@@]2([N@+]([C@](C1)(CC2)[H])([O-])C)[H])[H])=O)C=1C=CC=CC1