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Dipyron hydrate
SpectraBase Compound ID F4uVS2cFwup
InChI InChI=1S/C13H17N3O4S.Na.H2O/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;;/h4-8H,9H2,1-3H3,(H,18,19,20);;1H2/q;+1;/p-1
InChIKey UNZIDPIPYUMVPA-UHFFFAOYSA-M
Mol Weight 351.35276928 g/mol
Molecular Formula C13H18N3NaO5S
Exact Mass 351.086486 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HGa9jzLp9Nr
Name Dipyron hydrate
Source of Sample Riedel-De Haen Vetranal, Sigma-Aldrich Inc.
Catalog Number 46232
Lot Number 7200X
CAS Registry Number 5907-38-0
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N3NaO5S
InChI InChI=1S/C13H17N3O4S.Na.H2O/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;;/h4-8H,9H2,1-3H3,(H,18,19,20);;1H2/q;+1;/p-1
InChIKey UNZIDPIPYUMVPA-UHFFFAOYSA-M
Raman Corrections Referenced to internal white light source; 180 Degree backscatter
Raman Laser Source Nd: YAG
Raman Laser Wavelength 1064
Sadtler IR Number DW0224
Source of Spectrum Forensic Spectral Research
Synonyms Dipyrone; ((2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylamino)methanesulfonic acid, sodium salt, monohydrate
Technique FT-Raman