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Pyriftalid
SpectraBase Compound ID K6h1gL1AP6m
InChI InChI=1S/C15H14N2O4S/c1-8-9-5-4-6-10(13(9)14(18)21-8)22-15-16-11(19-2)7-12(17-15)20-3/h4-8H,1-3H3
InChIKey RRKHIAYNPVQKEF-UHFFFAOYSA-N
Mol Weight 318.35 g/mol
Molecular Formula C15H14N2O4S
Exact Mass 318.067428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6g50r6ICPSG
Name Pyriftalid
Source of Sample Sigma-Aldrich Cat. #33694
CAS Registry Number 135186-78-6
Classification Pesticides: Herbicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 318.067428109 u
Formula C15H14N2O4S
InChI InChI=1S/C15H14N2O4S/c1-8-9-5-4-6-10(13(9)14(18)21-8)22-15-16-11(19-2)7-12(17-15)20-3/h4-8H,1-3H3
InChIKey RRKHIAYNPVQKEF-UHFFFAOYSA-N
Molecular Weight 318.347 g/mol
Number of Peaks 50
RI1 2607
SMILES c12c(Sc3nc(cc(n3)OC)OC)cccc1C(OC2=O)C
SPLASH splash10-01b9-6589000000-855f9b5aef1c92c22e34
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1(3H)-Isobenzofuranone, 7-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3-methyl-
Wiley ID LM_PEST_647