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Atropine sulfate salt monohydrate
SpectraBase Compound ID A8lnvYtHioW
InChI InChI=1S/2C17H23NO3.H2O4S.O/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4;/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4);/t2*13-,14+,15-,16?;;
InChIKey IVIGTBARFHBIPX-OFGCMVCXSA-N
Mol Weight 692.82 g/mol
Molecular Formula C34H48N2O11S
Exact Mass 692.297882 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1RjlHSlwd9c
Name Atropine sulfate salt monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 852996
CAS Registry Number 5908-99-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H48N2O11S
InChI InChI=1S/2C17H23NO3.H2O4S.O/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4;/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4);/t2*13-,14+,15-,16?;;
InChIKey IVIGTBARFHBIPX-OFGCMVCXSA-N
Observed nucleus 1H
Purity 98%
Solvent D2O
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-(Hydroxymethyl)benzeneacetic acid 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester Tropine tropate
Wiley ID SIAL_1HNMR_010386