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 © 2023-2024 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 |
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 |