| SpectraBase Spectrum ID |
LoPsMsxu6Cu |
| Name |
Papuanone |
| CAS Registry Number |
222849-22-1 |
| 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 |
280.167459249 u |
| Formula |
C16H24O4 |
| InChI |
InChI=1S/C16H24O4/c1-6-7-8-9-10(17)11-12(18)15(2,3)14(20)16(4,5)13(11)19/h11H,6-9H2,1-5H3 |
| InChIKey |
IABBETLZKUEDLT-UHFFFAOYSA-N |
| Molecular Weight |
280.364 g/mol |
| Number of Peaks |
50 |
| RI1 |
1789 |
| SMILES |
C1(C(C(C(C(C1=O)C(CCCCC)=O)=O)(C)C)=O)(C)C |
| SPLASH |
splash10-0006-9320000000-e5c32be234730f96150c |
| 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 |
1,3,5-Cyclohexanetrione, 2,2,4,4-tetramethyl-6-(1-oxohexyl)- |
| Wiley ID |
LM_FFNSC3_2729 |
