| SpectraBase Spectrum ID |
HAPv3rtb5k6 |
| Name |
Phenethyl isobutyrate |
| Source of Sample |
SAFC Cat.no. W286206 |
| CAS Registry Number |
103-48-0 |
| 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 |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey |
JDQVBGQWADMTAM-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| Number of Peaks |
50 |
| RI1 |
1395 |
| RI2 |
1074 |
| RI3 |
1264 |
| RI4 |
1223 |
| SMILES |
C(C(C)C)(=O)OCCc1ccccc1 |
| SPLASH |
splash10-0udi-7900000000-53a4bbf1125740b4ba6a |
| 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 |
Propanoic acid, 2-methyl-, 2-phenylethyl ester |
| Wiley ID |
LM_FFNSC3_586 |
