| SpectraBase Spectrum ID |
6T4kqXb0DmT |
| Name |
Pentan-2-one <4-methyl-, 1-phenyl-> |
| Source of Sample |
SAFC Cat.no. W274003 |
| CAS Registry Number |
5349-62-2 |
| 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 |
176.120115134 u |
| Formula |
C12H16O |
| InChI |
InChI=1S/C12H16O/c1-10(2)8-12(13)9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey |
DTYGTEGDVPAKDA-UHFFFAOYSA-N |
| Molecular Weight |
176.259 g/mol |
| Number of Peaks |
50 |
| RI1 |
1354 |
| RI2 |
1032 |
| SMILES |
C(C(CC(C)C)=O)c1ccccc1 |
| SPLASH |
splash10-0a4u-9000000000-1340828a79b96e157866 |
| 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-Pentanone, 4-methyl-1-phenyl- |
| Wiley ID |
LM_FFNSC3_727 |
