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3-(p-hydroxyphenethyl)-4-(2,4-xylyl)-delta square-1,2,4-triazoline-5-thione

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3-(p-hydroxyphenethyl)-4-(2,4-xylyl)-delta square-1,2,4-triazoline-5-thione
SpectraBase Compound ID ESbyXlmfcDk
InChI InChI=1S/C18H19N3OS/c1-12-3-9-16(13(2)11-12)21-17(19-20-18(21)23)10-6-14-4-7-15(22)8-5-14/h3-5,7-9,11,22H,6,10H2,1-2H3,(H,20,23)
InChIKey ASQVWTNHYZMYBS-UHFFFAOYSA-N
Mol Weight 325.43 g/mol
Molecular Formula C18H19N3OS
Exact Mass 325.124883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gqom3EVj1jc
Name 3-(p-HYDROXYPHENETHYL)-4-(2,4-XYLYL)-delta2-1,2,4-TRIAZOLINE-5-THIONE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19N3OS
InChI InChI=1S/C18H19N3OS/c1-12-3-9-16(13(2)11-12)21-17(19-20-18(21)23)10-6-14-4-7-15(22)8-5-14/h3-5,7-9,11,22H,6,10H2,1-2H3,(H,20,23)
InChIKey ASQVWTNHYZMYBS-UHFFFAOYSA-N
Molecular Weight 325.44
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms TRIAZOLINE-5-THIONE, D<2-1,2,4-, 3-/P-HYDROXYPHENETHYL/-4-/2,4-XYLYL/-,