SpectraBase Spectrum ID |
EbMLuR2Jjz1 |
Name |
Butyrate <2-methyl-, phenylethyl-> |
Source of Sample |
SAFC Cat.no. W363200 |
CAS Registry Number |
24817-51-4 |
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/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3 |
InChIKey |
KVKKTLBBYFABAZ-UHFFFAOYSA-N |
Molecular Weight |
206.285 g/mol |
Number of Peaks |
50 |
RI1 |
1489 |
RI2 |
1167 |
SMILES |
c1cccc(c1)CCOC(C(CC)C)=O |
SPLASH |
splash10-0udi-5900000000-7362b0cb5ff3f7a76ea4 |
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, 2-methyl-, 2-phenylethyl ester |
Wiley ID |
LM_FFNSC3_780 |