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Atropinium cation (syn-methyl)

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Atropinium cation (syn-methyl)
SpectraBase Compound ID AD1FOPzI32J
InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/p+1
InChIKey RKUNBYITZUJHSG-UHFFFAOYSA-O
Mol Weight 290.38 g/mol
Molecular Formula C17H24NO3
Exact Mass 290.175619 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BKHxoBsRtqJ
Name Atropinium cation (syn-methyl)
Comments MEASURED AS N-DEUTERIO COMPOUND CHLORIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H24NO3
InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/p+1
InChIKey RKUNBYITZUJHSG-UHFFFAOYSA-O
Instrument Name Varian XL-100
Literature Reference K.H. Pook, W. Schulz, Liebigs Ann. Chem. 1499 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Mixture