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Atropine sulfate monohydrate
SpectraBase Compound ID 1hukSu07vsJ
InChI InChI=1S/2C17H23NO3.H2O4S.H2O/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);1H2/t2*13-,14+,15+,16?;;
InChIKey JPKKQJKQTPNWTR-CHYDPLAESA-N
Mol Weight 694.837 g/mol
Molecular Formula C34H50N2O11S
Exact Mass 694.313532 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID C8lGlMdnQqk
Name Atropine sulfate monohydrate
Source of Sample Alltech Associates, Inc., Grace Davison Discovery Sciences
Catalog Number 01840
Lot Number 1602
CAS Registry Number 5908-99-6
Classification Anticholinergic
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H50N2O11S
InChI InChI=1S/2C17H23NO3.H2O4S.H2O/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);1H2/t2*13-,14+,15+,16?;;
InChIKey JPKKQJKQTPNWTR-CHYDPLAESA-N
Raman Corrections Referenced to internal white light source; 180 Degree backscatter
Raman Laser Source Nd: YAG
Raman Laser Wavelength 1064
Sadtler IR Number DW0478
Source of Spectrum Forensic Spectral Research
Synonyms alpha-(Hydroxymethyl)benzeneacetic acid, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, endo-(+-)-, sulfate (2:1) (salt), monohydrate
Technique FT-Raman