| SpectraBase Spectrum ID |
IJduYzuEfUp |
| Name |
Perilla ketone |
| CAS Registry Number |
553-84-4 |
| 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 |
166.099379689 u |
| Formula |
C10H14O2 |
| InChI |
InChI=1S/C10H14O2/c1-8(2)3-4-10(11)9-5-6-12-7-9/h5-8H,3-4H2,1-2H3 |
| InChIKey |
LVHLZMUFIYAEQB-UHFFFAOYSA-N |
| Molecular Weight |
166.220 g/mol |
| Number of Peaks |
37 |
| RI1 |
1250 |
| SMILES |
c1occc1C(=O)CCC(C)C |
| SPLASH |
splash10-01ot-9400000000-1a646145211b990843d4 |
| 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-Pentanone, 1-(3-furanyl)-4-methyl- |
| Wiley ID |
LM_FFNSC3_2366 |
