| SpectraBase Spectrum ID |
33HkvPOzBsA |
| Name |
MYCLOBUTANIL |
| CAS Registry Number |
88671-89-0 |
| 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 |
288.114174263 u |
| Formula |
C15H17ClN4 |
| InChI |
InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3 |
| InChIKey |
HZJKXKUJVSEEFU-UHFFFAOYSA-N |
| Molecular Weight |
288.782 g/mol |
| Nominal Mass |
288 u |
| Number of Peaks |
97 |
| SMILES |
C(C(c1ccc(cc1)Cl)(CCCC)C[n]1cncn1)#N |
| SPLASH |
splash10-0ke9-4920000000-e34ca552ae68ca668c99 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4420 |
