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A-(-)-N-Propynyl-normetazocine cation

View entire compound with spectra: 4 NMR

A-(-)-N-Propynyl-normetazocine cation
SpectraBase Compound ID GTDbYoaXY1a
InChI InChI=1S/C17H21NO/c1-4-8-18-9-7-17(3)12(2)16(18)11-13-10-14(19)5-6-15(13)17/h1,5-6,10,12,16,19H,7-9,11H2,2-3H3/p+1/t12-,16+,17+/m0/s1
InChIKey CXYJHQHUNCOSJX-JCURWCKSSA-O
Mol Weight 256.37 g/mol
Molecular Formula C17H22NO
Exact Mass 256.170139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A2MQe73Yetx
Name A-(-)-N-Propynyl-normetazocine cation
Comments HYDROBROMIDE, VARIAN VXR-400 SPECTROMETER, D20/ TFA 5/1 AS SOLVENT, MINOR ISOMER
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Formula C17H22NO
InChI InChI=1S/C17H21NO/c1-4-8-18-9-7-17(3)12(2)16(18)11-13-10-14(19)5-6-15(13)17/h1,5-6,10,12,16,19H,7-9,11H2,2-3H3/p+1/t12-,16+,17+/m0/s1
InChIKey CXYJHQHUNCOSJX-JCURWCKSSA-O
Instrument Name see comment
Literature Reference M.E. Amato, A. Grassi, G.C. Pappalardo, Magn. Res. Chem. 30, 20 (1992).
NMR Standard TMS-Propi Na
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany