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[2-(2,4,6-trichlorophenoxy)ethyl]guanidine, hemisulfate

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[2-(2,4,6-trichlorophenoxy)ethyl]guanidine, hemisulfate
SpectraBase Compound ID DgMnbUp7675
InChI InChI=1S/2C9H10Cl3N3O.H2O4S/c2*10-5-3-6(11)8(7(12)4-5)16-2-1-15-9(13)14;1-5(2,3)4/h2*3-4H,1-2H2,(H4,13,14,15);(H2,1,2,3,4)
InChIKey ZMFNCIJIHALTOH-UHFFFAOYSA-N
Mol Weight 331.59 g/mol
Molecular Formula C9H10Cl3N3O·½H2O4S
Exact Mass 329.972635 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DVVyJEIsYt
Name [2-(2,4,6-trichlorophenoxy)ethyl]guanidine, hemisulfate
Source of Sample F. C. Copp & H. F. Hodson, the Wellcome Research Laboratories, Kent, England
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22Cl6N6O6S
InChI InChI=1S/2C9H10Cl3N3O.H2O4S/c2*10-5-3-6(11)8(7(12)4-5)16-2-1-15-9(13)14;1-5(2,3)4/h2*3-4H,1-2H2,(H4,13,14,15);(H2,1,2,3,4)
InChIKey ZMFNCIJIHALTOH-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference Abstract-Chemical Abstracts= 60, 2824(1964)
Sadtler NMR Number 1510M
Solvent TFA
Synonyms GUANIDINE, /2-/2,4,6-TRICHLORO- PHENOXY/ETHYL/-, HEMISULFATE