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3.alpha.-cis-Cinnamoyloxytropane
SpectraBase Compound ID CiA8AsZ2YrY
InChI InChI=1S/C17H21NO2/c1-18-14-8-9-15(18)12-16(11-14)20-17(19)10-7-13-5-3-2-4-6-13/h2-7,10,14-16H,8-9,11-12H2,1H3/b10-7-/t14-,15+,16-
InChIKey WTIWQHQPUWFUPX-QTAOSREISA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCY2j9PzOiR
Name 3.alpha.-cis-Cinnamoyloxytropane
Appearance White amorphous powder
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Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-18-14-8-9-15(18)12-16(11-14)20-17(19)10-7-13-5-3-2-4-6-13/h2-7,10,14-16H,8-9,11-12H2,1H3/b10-7-/t14-,15+,16-
InChIKey WTIWQHQPUWFUPX-QTAOSREISA-N
Instrument Name Varian MAT 312 double focusing
Ionization Type EI
Literature Reference DOI 10.1021/np010221y
Molecular Weight 271.360 g/mol
Reported Formula C17H21NO2
SMILES [C@@]12(CC[C@@](N2C)(C[C@](C1)(OC(\C=C/c1ccccc1)=O)[H])[H])[H]
SPLASH splash10-008a-9500000000-12927ebe64275acbe947
Source of Spectrum G4-65-931-3
Thin-Layer Chromatography Rf = 0.62 (ammonia vapor, CHCl3/MeOH, 95:5)
Wiley ID 1883664