| SpectraBase Spectrum ID |
HmgLkdC2YCe |
| Name |
Metkonazole |
| CAS Registry Number |
125116-23-6 |
| 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 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| 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 |
| Nominal Mass |
319 u |
| Number of Peaks |
196 |
| SMILES |
OC1(C(CCC1Cc1ccc(Cl)cc1)(C)C)C[n]1ncnc1 |
| SPLASH |
splash10-004i-5910000000-32518b196422479aa385 |
| Source |
Sigma-Aldrich |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001080 |
