SpectraBase Spectrum ID |
7n5HHMrpX50 |
Name |
Metconazole |
Source of Sample |
Sigma-Aldrich Cat. #37909 |
CAS Registry Number |
125116-23-6 |
Classification |
Pesticides: Fungicides |
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 |
319.145140039 u |
Formula |
C17H22ClN3O |
InChI |
InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3 |
InChIKey |
XWPZUHJBOLQNMN-UHFFFAOYSA-N |
Molecular Weight |
319.836 g/mol |
Number of Peaks |
48 |
RI1 |
2497 |
SMILES |
OC1(C(Cc2ccc(Cl)cc2)CCC1(C)C)C[n]1ncnc1 |
SPLASH |
splash10-00au-9500000000-79367fb98db39aa95791 |
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 |
Cyclopentanol, 5-[(4-chlorophenyl)methyl]-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)- |
Wiley ID |
LM_PEST_197 |