| SpectraBase Spectrum ID |
DYsOTInyknx |
| Name |
Pentyl phenylacetate |
| CAS Registry Number |
5137-52-0 |
| 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 |
206.130679818 u |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-2-3-7-10-15-13(14)11-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3 |
| InChIKey |
LRVLBFSVAFUOGO-UHFFFAOYSA-N |
| Molecular Weight |
206.285 g/mol |
| Number of Peaks |
50 |
| RI1 |
1535 |
| RI2 |
1212 |
| RI3 |
1773 |
| RI4 |
1734 |
| RI5 |
1505 |
| SMILES |
c1(ccccc1)CC(=O)OCCCCC |
| SPLASH |
splash10-0006-9200000000-dae5dc87b627374025bd |
| 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 |
Benzeneacetic acid, pentyl ester |
| Wiley ID |
LM_FFNSC3_3318 |
