| SpectraBase Spectrum ID |
72712P4rvZl |
| Name |
Phenethyl butyrate |
| Source of Sample |
SAFC Cat.no. W239402 |
| CAS Registry Number |
10094-34-5 |
| 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 |
220.146329882 u |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h5-7,9-10H,4,8,11H2,1-3H3 |
| InChIKey |
SHSGYHAHMQLYRB-UHFFFAOYSA-N |
| Molecular Weight |
220.312 g/mol |
| Number of Peaks |
50 |
| RI1 |
1490 |
| RI2 |
1168 |
| RI3 |
1275 |
| RI4 |
1230 |
| RI5 |
1474 |
| SMILES |
C(CCC)(=O)OC(Cc1ccccc1)(C)C |
| SPLASH |
splash10-00dl-9200000000-140ec85b07dd263bce4b |
| 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 |
Butanoic acid, 1,1-dimethyl-2-phenylethyl ester |
| Wiley ID |
LM_FFNSC3_72 |
