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Tropine hydrate

View entire compound with spectra: 2 NMR, and 2 FTIR

Tropine hydrate
SpectraBase Compound ID 1NIeXpbA6L9
InChI InChI=1S/C8H15NO.O/c1-9-6-2-3-7(9)5-8(10)4-6;/h6-8,10H,2-5H2,1H3;/t6-,7+,8?;
InChIKey SCLQKKQKONKTIJ-PAFGHYSMSA-N
Mol Weight 157.21 g/mol
Molecular Formula C8H15NO2
Exact Mass 157.110279 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JtBJFAbgDfL
Name Tropine hydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number T89400
CAS Registry Number 180515-56-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15NO2
InChI InChI=1S/C8H15NO.O/c1-9-6-2-3-7(9)5-8(10)4-6;/h6-8,10H,2-5H2,1H3;/t6-,7+,8?;
InChIKey SCLQKKQKONKTIJ-PAFGHYSMSA-N
Observed nucleus 13C
Purity >=98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2,3-Dihydro-3a-hydroxy-8-methylnortropidine 3-Tropanol, N-Methyl-8-azabicyclo[3.2.1]octan-3-ol endo-8-Methyl-8-azabicyclo[3.2.1]octan-3-ol
Wiley ID SIAL_13CNMR_012967