| SpectraBase Spectrum ID |
BTPBlK3f2pb |
| Name |
Hexyl methyl ketone |
| Source of Sample |
SAFC Cat.no. W280208 |
| CAS Registry Number |
111-13-7 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
128.120115134 u |
| Formula |
C8H16O |
| InChI |
InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3 |
| InChIKey |
ZPVFWPFBNIEHGJ-UHFFFAOYSA-N |
| Molecular Weight |
128.215 g/mol |
| Number of Peaks |
41 |
| RI1 |
1843 |
| RI5 |
1834 |
| SMILES |
C(CCCCCC)(C)=O |
| SPLASH |
splash10-052f-9000000000-9b62caace23fbfc22a7a |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2-Octanone |
| Wiley ID |
LM_FFNSC3_582 |
