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3.alpha.-Hydroxy-7.beta.-phenylacetoxynortropane
SpectraBase Compound ID JjBd30OQBv
InChI InChI=1S/C15H19NO3/c17-12-7-11-8-14(13(9-12)16-11)19-15(18)6-10-4-2-1-3-5-10/h1-5,11-14,16-17H,6-9H2/t11-,12+,13+,14-/m1/s1
InChIKey LZGZKTSKMTXSGV-ZOBORPQBSA-N
Mol Weight 261.32 g/mol
Molecular Formula C15H19NO3
Exact Mass 261.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DA8kvE82pk
Name 3.alpha.-Hydroxy-7.beta.-phenylacetoxynortropane
Appearance Off-white amorphous powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO3
InChI InChI=1S/C15H19NO3/c17-12-7-11-8-14(13(9-12)16-11)19-15(18)6-10-4-2-1-3-5-10/h1-5,11-14,16-17H,6-9H2/t11-,12+,13+,14-/m1/s1
InChIKey LZGZKTSKMTXSGV-ZOBORPQBSA-N
Instrument Name Varian MAT 312 double focusing
Ionization Type EI
Literature Reference DOI 10.1021/np010221y
Molecular Weight 261.321 g/mol
Optical Rotation [a]D25 = 7.2 (c = 0.25, MeOH)
Reported Formula C15H19NO3
SMILES N1[C@]2(C[C@]([C@@]1(C[C@](C2)(O)[H])[H])(OC(Cc1ccccc1)=O)[H])[H]
SPLASH splash10-0002-9100000000-c695330c39419771eb4e
Source of Spectrum G4-65-931-2
Thin-Layer Chromatography Rf = 0.51 (ammonia vapor, CHCl3/MeOH, 95:5)
Wiley ID 1883663