SpectraBase Spectrum ID |
2R7c3s5iMpf |
Name |
Phenethyl hexanoate |
Source of Sample |
SAFC Cat.no. W322105 |
CAS Registry Number |
6290-37-5 |
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/c1-2-3-5-10-14(15)16-12-11-13-8-6-4-7-9-13/h4,6-9H,2-3,5,10-12H2,1H3 |
InChIKey |
BUYNWUMUDHPPDS-UHFFFAOYSA-N |
Molecular Weight |
220.312 g/mol |
Number of Peaks |
50 |
RI1 |
1643 |
RI2 |
1321 |
SMILES |
c1cccc(c1)CCOC(CCCCC)=O |
SPLASH |
splash10-0udi-5900000000-376c5b566d73e3844c11 |
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 |
Hexanoic acid, 2-phenylethyl ester |
Wiley ID |
LM_FFNSC3_766 |