| SpectraBase Spectrum ID |
FxZ1njfqrXB |
| Name |
Hexan-4-one <2-methyl-, 2-phenyl-> |
| CAS Registry Number |
4927-36-0 |
| 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 |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-4-12(14)10-13(2,3)11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3 |
| InChIKey |
VEZKFOIEZCNFBT-UHFFFAOYSA-N |
| Molecular Weight |
190.286 g/mol |
| Number of Peaks |
50 |
| RI1 |
1416 |
| RI2 |
1095 |
| SMILES |
c1cc(ccc1)C(CC(CC)=O)(C)C |
| SPLASH |
splash10-014i-6900000000-153e633703fc721b3b26 |
| 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 |
3-Hexanone, 5-methyl-5-phenyl- |
| Wiley ID |
LM_FFNSC3_1252 |
