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(4-methyl-6-prop-1-ynyl-pyrimidin-2-yl)-phenyl-amine
SpectraBase Compound ID f9UtCsJfVF
InChI InChI=1S/C14H13N3/c1-3-7-13-10-11(2)15-14(17-13)16-12-8-5-4-6-9-12/h4-6,8-10H,1-2H3,(H,15,16,17)
InChIKey CIFWZNRJIBNXRE-UHFFFAOYSA-N
Mol Weight 223.28 g/mol
Molecular Formula C14H13N3
Exact Mass 223.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aqo8aoDt0XZ
Name Mepanipyrim
Source of Sample Sigma-Aldrich Cat. #33970
CAS Registry Number 110235-47-7
Classification Pesticides
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 223.110947431 u
Formula C14H13N3
InChI InChI=1S/C14H13N3/c1-3-7-13-10-11(2)15-14(17-13)16-12-8-5-4-6-9-12/h4-6,8-10H,1-2H3,(H,15,16,17)
InChIKey CIFWZNRJIBNXRE-UHFFFAOYSA-N
Molecular Weight 223.279 g/mol
Number of Peaks 50
RI1 2134
SMILES N(c1nc(C#CC)cc(n1)C)c1ccccc1
SPLASH splash10-00di-2190000000-d5d3b08864904eaa3d6f
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 2-Pyrimidinamine, 4-methyl-N-phenyl-6-(1-propyn-1-yl)-
Wiley ID LM_PEST_84