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3-α-Benzoyloxytropane

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-α-Benzoyloxytropane
SpectraBase Compound ID 3idwEOBJMzf
InChI InChI=1S/C15H19NO2/c1-16-12-7-8-13(16)10-14(9-12)18-15(17)11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3/t12-,13+,14+
InChIKey XQJMXPAEFMWDOZ-WDNDVIMCSA-N
Mol Weight 245.32 g/mol
Molecular Formula C15H19NO2
Exact Mass 245.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fb2AyF8F6Cd
Name 3.alpha.-Benzoyloxytropane
Catalog Number 33573
CAS Registry Number 55623-27-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO2
InChI InChI=1S/C15H19NO2/c1-16-12-7-8-13(16)10-14(9-12)18-15(17)11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3/t12-,13+,14+
InChIKey XQJMXPAEFMWDOZ-WDNDVIMCSA-N
Molecular Weight 245.322 g/mol
SMILES CN1[C@]2(C[C@](OC(c3ccccc3)=O)(C[C@@]1(CC2)[H])[H])[H]
SPLASH splash10-00ec-9400000000-92432a5b510f5a52e8b4
Source of Spectrum CAY-2023-11-0
Wiley ID 1887977